SCHEMBL58473

SCHEMBL58473

[O]C1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.46
HTR2A P28223 1/20 0.46
NCOR2 Q9Y618 2/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
POLB P06746 3/20 0.43
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
CDC25B P30305 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
S100A4 P26447 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CES2 O00748 1/20 0.38
APAF1 O14727 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18243404 0.75 PPIA (0.33) GPR3HTR2ANCOR2HDAC3HDAC4
SCHEMBL40599 0.75 GPR3 (0.52) GPR3HTR2ANCOR2HDAC3HDAC4
SCHEMBL18242520 0.75 PPIA (0.49) CA1CA2
SCHEMBL29641604 0.75 GPR3 (0.52) GPR3HTR2ANCOR2HDAC3HDAC4
SCHEMBL18242146 0.75 HTR7 (0.41) KMT2AMEN1KDM4ELMNAHTT
SCHEMBL524603 0.73 GPR3 (0.50) GPR3HTR2ANCOR2HDAC3HDAC4
SCHEMBL29950614 0.73 GPR3 (0.50) GPR3HTR2ANCOR2HDAC3HDAC4
SCHEMBL5593897 0.73 POLB (0.52) NCOR2HDAC3HDAC4HDAC7HDAC8
SCHEMBL825558 0.71 HTR2A (0.55) GPR3HTR2ANCOR2HDAC3HDAC4
SCHEMBL1107108 0.71 GPR3 (0.48) GPR3HTR2ANCOR2HDAC3HDAC4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 843 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114276372-A Boron-containing condensed ring compound for OLED light-emitting layer and application thereof 江苏三月科技股份有限公司 2022-04-05 CN claimed
CN-107963972-B Organic electroluminescent device 保土谷化学工业株式会社 2021-09-03 CN claimed
US-10745372-B2 Compound, resin, material for forming underlayer film for lithography, underlayer film for lithography, pattern forming method, and purification method MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2020-08-18 US claimed
CN-111377847-A Heterocyclic compound, composition comprising the same, and organic light-emitting device comprising the heterocyclic compound 三星电子株式会社 2020-07-07 CN claimed
EP-2545024-B1 PROCESS FOR PREPARATION OF 3-(2-HYDROXY-5-SUBSTITUTED PHENYL)-3-PHENYLPROPYLAMINES, INTERMEDIATES FOR MAKING HYDROXYTOLTERODINE AND FESOTERODINE LEK PHARMACEUTICALS (SI) 2016-08-03 EP claimed
US-8703996-B2 Short synthesis of tolterodin, intermediates and metabolites LEK PHARMACEUTICALS D.D. (SI) 2014-04-22 US claimed
US-20130197082-A1 SHORT SYNTHESIS OF TOLTERODINE, INTERMEDIATES AND METABOLITES LEK PHARMACEUTICALS D.D. (SI) 2013-08-01 US claimed
EP-2326654-B1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND ALPHA- OLEFINS USING THE SAME. SK INNOVATION CO LTD (KR) 2013-03-20 EP claimed
EP-2545024-A1 SHORT SYNTHESIS OF TOLTERODINE, INTERMEDIATES AND METABOLITES LEK Pharmaceuticals d.d. (SI) 2013-01-16 EP claimed
US-8232359-B2 Process for preparing ethylene homopolymers or copolymers of ethylene with α-olefin by using the transition metal compound SK INNOVATION CO., LTD. (KR) 2012-07-31 US claimed
WO-2011110556-A1 SHORT SYNTHESIS OF TOLTERODINE, INTERMEDIATES AND METABOLITES LEK PHARMACEUTICALS D.D. (SI) 2011-09-15 WO claimed
EP-2364966-A1 Process for preparation of 3-(2-hydroxy-5-substituted phenyl)-3-phenylpropylamines, intermediates for making hydroxytolterodine LEK Pharmaceuticals d.d. (SI) 2011-09-14 EP claimed
EP-2326654-A2 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND - OLEFINS USING THE SAME. SK Energy Co., Ltd. (KR) 2011-06-01 EP claimed
US-20110098426-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF THE ETHYLENE AND a-OLEFINS USING THE SAME SK ENERGY CO., LTD. (KR) 2011-04-28 US claimed
US-7928173-B2 Transition metal catalytic systems and methods for preparing ethylene homopolymers or copolymers of ethylene and α-olefins using the same SK ENERGY CO., LTD. (KR) 2011-04-19 US claimed
US-20100081776-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND a-OLEFINS USING THE SAME SABIC SK NEXLENE COMPANY PTE. LTD. (SG) 2010-04-01 US claimed
WO-2010036025-A2 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND α- OLEFINS USING THE SAME. SK ENERGY CO., LTD. (KR) 2010-04-01 WO claimed
US-6677473-B1 TREATMENT, PREVENTION OR AMELIORATION OF ONE OR MORE SYMPTOMS OF THROMBOTIC DISORDERS, UNSTABLE ANGINA OR CANCER CORVAS INTERNATIONAL INC 2004-01-13 US claimed
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 WO claimed
US-5776932-A ANTIALLERGENS, ANTIASTHMATICS, ANTIINFLAMMATORY AGENTS AND MODULATORS ARZNEIMITTELWERK DRESDEN G.M.B.H. (DE) 1998-07-07 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130197082-A1 SHORT SYNTHESIS OF TOLTERODINE, INTERMEDIATES AND METABOLITES COMT, UGT1A7, PAH GPR3 1212/4885HTR2A 894/4885NCOR2 3817/4885
US-20100081776-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF ETHYLENE AND a-OLEFINS USING THE SAME ESR1, AOC3, PPOX GPR3 3346/4885HTR2A 4630/4885NCOR2 2402/4885
US-20110098426-A1 TRANSITION METAL CATALYTIC SYSTEMS AND METHODS FOR PREPARING ETHYLENE HOMOPOLYMERS OR COPOLYMERS OF THE ETHYLENE AND a-OLEFINS USING THE SAME ESR1, AOC3, AOC2 GPR3 3118/4885HTR2A 4584/4885NCOR2 2350/4885
US-10745372-B2 Compound, resin, material for forming underlayer film for lithography, underlayer film for lithography, pattern forming method, and purification method ASH2L, MLLT1, FRG1 GPR3 3887/4885HTR2A 2703/4885NCOR2 940/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.