SCHEMBL8088810

SCHEMBL8088810

CC(C#N)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
ALDH1A1 P00352 3/20 0.46
ALPG P10696 2/20 0.46
TDP1 Q9NUW8 1/20 0.43
HPGD P15428 2/20 0.41
HTT P42858 2/20 0.41
USP2 O75604 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
IDO1 P14902 2/20 0.38
TDO2 P48775 2/20 0.38
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
ACHE P22303 1/20 0.36
KMT2A Q03164 1/20 0.36
AOC3 Q16853 1/20 0.34
DAO P14920 1/20 0.34
CTSL P07711 2/20 0.34

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
SCHEMBL6565095 0.87 ESR1 (0.43) ALDH1A1CYP11B1CYP11B2ESR1ESR2
SCHEMBL955060 0.80 TYR (0.41) LMNASMN1; SMN2ALDH1A1HPGDHTT
SCHEMBL958687 0.78 ALDH1A1 (0.44) LMNASMN1; SMN2ALDH1A1TDP1CYP11B1
SCHEMBL7967104 0.77 ESR1 (0.47) LMNASMN1; SMN2ALDH1A1ALPGTDP1
SCHEMBL4160843 0.76 ALOX5 (0.41) SMN1; SMN2ALDH1A1HPGDCYP11B1CYP11B2
SCHEMBL6141138 0.76 IDO1 (0.38) LMNASMN1; SMN2ALDH1A1ALPGTDP1
SCHEMBL12263781 0.76 ESR1 (0.36) ALDH1A1CYP11B1CYP11B2ESR1ESR2
SCHEMBL4145904 0.76 MEN1 (0.38) SMN1; SMN2ALDH1A1TDP1HPGDHTT
SCHEMBL909757 0.76 ADRB2 (0.50) LMNASMN1; SMN2ALDH1A1TDP1HPGD
SCHEMBL450037 0.76 ESR1 (0.61) LMNASMN1; SMN2ALDH1A1TDP1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250243208-A1 BICYCLIC HETEROCYCLES AS MRGPRX2 ANTAGONISTS INCYTE CORPORATION 2025-07-31 US disclosed
EP-3383838-B1 PROCESS FOR THE CATALYTIC REVERSIBLE UNSATURATED HYDROCARBON-NITRILE INTERCONVERSION STUDIENGESELLSCHAFT KOHLE GGMBH (DE) 2023-10-25 EP disclosed
US-11253499-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-02-22 US disclosed
US-11253499-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-02-22 US disclosed
EP-3668854-B1 NOVEL COMPOUNDS GLAXOSMITHKLINE IP DEV LTD (GB) 2022-01-12 EP disclosed
EP-3668854-B1 NOVEL COMPOUNDS GLAXOSMITHKLINE IP DEV LTD (GB) 2022-01-12 EP disclosed
EP-3668854-A1 NOVEL COMPOUNDS GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-06-24 EP disclosed
US-20200170997-A1 NOVEL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-06-04 US disclosed
US-20200170997-A1 NOVEL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-06-04 US disclosed
CN-111225909-A Novel compounds 葛兰素史密斯克莱知识产权发展有限公司 2020-06-02 CN disclosed
CN-1284056-A Anticonvulsant and sentral nervous system-active bis (fluorophenyl) alkylamides NPS PHARMA INC (US) 2001-02-14 CN disclosed
EP-1042275-A1 ANTICONVULSANT AND CENTRAL NERVOUS SYSTEM-ACTIVE BIS(FLUOROPHENYL)ALKYLAMIDES NPS PHARMACEUTICALS, INC. (US) 2000-10-11 EP disclosed
WO-1999029657-A1 ANTICONVULSANT AND CENTRAL NERVOUS SYSTEM-ACTIVE BIS(FLUOROPHENYL)ALKYLAMIDES NPS PHARMACEUTICALS, INC. (US) 1999-06-17 WO disclosed
EP-0170316-B1 ALPHA-ARYL-4-(4,5-DIHYDRO-3,5-DIOXO-1,2,4-TRIAZIN-2(3H)-YL)BENZENEACETONITRILES JANSSEN PHARMACEUTICA N.V. (BE) 1990-05-30 EP disclosed
US-4778887-A ANTIPROTOZOA AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1988-10-18 US disclosed
US-4631278-A Anti-protozoal α-aryl-4-(4,5-dihydro-3,5-dioxo-1,2,4-triazin-2(3H)-yl)-benzeneacetonitrile derivatives, pharmaceutical compositions, and method of use therefor JANSSEN PHARMACEUTICA N.V. (BE) 1986-12-23 US disclosed
US-4599362-A 2-aryl-ethyl ether derivatives and insecticidal and acaricidal agents containing said derivatives MITSUITOATSU CHEMICALS, INC. (JP) 1986-07-08 US disclosed
US-4570005-A REACTING THE ARYL PROPYL CHLORIDE WITH THE CORRESPONDING ARYL ALCOHOL OR ARYL MERCAPTAN MITSUITOATSU CHEMICALS INC. (JP) 1986-02-11 US disclosed
EP-0170316-A2 alpha-Aryl-4-(4,5-dihydro-3,5-dioxo-1,2,4-triazin-2(3H)-yl)benzeneacetonitriles JANSSEN PHARMACEUTICA N.V. (BE) 1986-02-05 EP disclosed
US-4397864-A LOW TOXICITY MITSUITOATSU CHEMICALS INC. (JP) 1983-08-09 US disclosed

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

For each of this compound's patents that has machine-readable text (3 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-11253499-B2 Compounds SDHA, SDHB, FDPS LMNA 2414/4885SMN1; SMN2 3636/4885ALDH1A1 207/4885
US-20250243208-A1 BICYCLIC HETEROCYCLES AS MRGPRX2 ANTAGONISTS MRGPRX2, MRGPRX1, MRGPRX4 LMNA 3582/4885SMN1; SMN2 4447/4885ALDH1A1 3361/4885
US-20200170997-A1 NOVEL COMPOUNDS FNTB, SDHA, FDPS LMNA 2533/4885SMN1; SMN2 4087/4885ALDH1A1 791/4885

“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.