SCHEMBL749352

SCHEMBL749352

O=C(OCc1ccccc1)N1CC=C(c2ccc(O)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.54
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
NPSR1 Q6W5P4 1/20 0.51
LNPEP Q9UIQ6 1/20 0.51
SMN1; SMN2 Q16637 4/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
CYP2C19 P33261 1/20 0.48
PRMT1 Q99873 1/20 0.47
ALDH1A1 P00352 4/20 0.47
ALOX15 P16050 3/20 0.47
TSHR P16473 1/20 0.47
CNR1 P21554 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.46
MAPT P10636 3/20 0.46
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HPGD P15428 2/20 0.45

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
SCHEMBL8315932 0.93 MEN1 (0.57) GRM5MEN1KMT2ANPSR1LNPEP
SCHEMBL22563072 0.90 GRM5 (0.52) GRM5MEN1KMT2ANPSR1LNPEP
SCHEMBL15747743 0.90 LNPEP (0.54) GRM5MEN1KMT2ANPSR1LNPEP
SCHEMBL21384574 0.88 TDP1 (0.50) GRM5MEN1KMT2ANPSR1LNPEP
SCHEMBL3714668 0.87 SMN1; SMN2 (0.44) GRM5MEN1KMT2ANPSR1LNPEP
SCHEMBL31131400 0.86 LNPEP (0.49) GRM5MEN1KMT2ANPSR1LNPEP
SCHEMBL22551243 0.86 LNPEP (0.49) GRM5MEN1KMT2ANPSR1LNPEP
SCHEMBL25929764 0.86 LNPEP (0.49) GRM5MEN1KMT2ANPSR1LNPEP
SCHEMBL6395476 0.86 NPC1 (0.53) GRM5LNPEPSMN1; SMN2NPC1RAB9A
SCHEMBL29995210 0.86 MEN1 (0.54) GRM5MEN1KMT2ANPSR1LNPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230035133-A1 [1,2,4]Triazolo[4,3-B]Pyridazines For Use in the Treatment of Proliferative Diseases ASTRAZENECA AB (SE) 2023-02-02 US disclosed
US-20230035133-A1 [1,2,4]Triazolo[4,3-B]Pyridazines For Use in the Treatment of Proliferative Diseases ASTRAZENECA AB (SE) 2023-02-02 US disclosed
US-11407755-B2 [1,2,4]triazolo[4,3-b]pyridazines for use in the treatment of proliferative diseases ASTRAZENECA AB (SE) 2022-08-09 US disclosed
US-20210107905-A1 1,2,4]TRIAZOLO[4,3-B]PYRIDAZINES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES ASTRAZENECA AB (SE) 2021-04-15 US disclosed
US-20210107905-A1 1,2,4]TRIAZOLO[4,3-B]PYRIDAZINES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES ASTRAZENECA AB (SE) 2021-04-15 US disclosed
US-10766905-B2 [1,2,4]triazolo[4,3-B]pyridazines for use in the treatment of proliferative diseases ASTRAZENECA AB (SE) 2020-09-08 US disclosed
US-10766905-B2 [1,2,4]triazolo[4,3-B]pyridazines for use in the treatment of proliferative diseases ASTRAZENECA AB (SE) 2020-09-08 US disclosed
US-20200055861-A1 [1,2,4]TRIAZOLO[4,3-B]PYRIDAZINES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES ASTRAZENECA UK LIMITED (GB) 2020-02-20 US disclosed
US-20200055861-A1 [1,2,4]TRIAZOLO[4,3-B]PYRIDAZINES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES ASTRAZENECA UK LIMITED (GB) 2020-02-20 US disclosed
US-10407432-B2 [1,2,4]triazolo[4,3-B]pyridazines for use in the treatment of proliferative diseases ASTRAZENECA AB (SE) 2019-09-10 US disclosed
EP-2430024-A1 [1,2,4]TRIAZOLO [4,3-B]PYRIDAZINES AS LIGANDS OF THE ANDROGEN RECEPTOR AstraZeneca AB (SE) 2012-03-21 EP disclosed
EP-2396333-A1 TRIAZOLO [4,3-B]PYRIDAZINE DERIVATIVES AND THEIR USES FOR PROSTATE CANCER AstraZeneca AB (SE) 2011-12-21 EP disclosed
US-8003649-B2 Bicyclic derivatives for use in the treatment of androgen receptor associated conditions-155 ASTRAZENECA AB (SE) 2011-08-23 US disclosed
WO-2010131022-A1 [1,2,4] TRIAZOLO [4,3-B] PYRIDAZINES AS LIGANDS OF THE ANDROGEN RECEPTOR ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
US-20100292222-A1 CHEMICAL COMPOUNDS 751 ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100267699-A1 CHEMICAL COMPOUNDS - 643 ASTRAZENECA R&D 2010-10-21 US disclosed
EP-2235010-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS AstraZeneca AB (SE) 2010-10-06 EP disclosed
WO-2010092371-A1 TRIAZOLO [4,3-B] PYRIDAZINE DERIVATIVES AND THEIR USES FOR PROSTATE CANCER ASTRAZENECA AB (SE) 2010-08-19 WO disclosed
US-20100016279-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS-155 ASTRAZENECA AB (SE) 2010-01-21 US disclosed
WO-2009081197-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS ASTRAZENECA AB (SE) 2009-07-02 WO 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 (9 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-10407432-B2 [1,2,4]triazolo[4,3-B]pyridazines for use in the treatment of proliferative diseases MKI67, CCNB1, CCNB2 GRM5 3828/4885MEN1 619/4885KMT2A 2735/4885
US-20100292222-A1 CHEMICAL COMPOUNDS 751 AR, NR5A1, KLK3 GRM5 442/4885MEN1 476/4885KMT2A 1270/4885
US-20200055861-A1 [1,2,4]TRIAZOLO[4,3-B]PYRIDAZINES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES MKI67, CCNB1, CCNB2 GRM5 3828/4885MEN1 619/4885KMT2A 2735/4885
US-20210107905-A1 1,2,4]TRIAZOLO[4,3-B]PYRIDAZINES FOR USE IN THE TREATMENT OF PROLIFERATIVE DISEASES MKI67, CCNB1, BCL2 GRM5 3878/4885MEN1 794/4885KMT2A 2678/4885
US-11407755-B2 [1,2,4]triazolo[4,3-b]pyridazines for use in the treatment of proliferative diseases MKI67, CCNB1, CCNB2 GRM5 3828/4885MEN1 619/4885KMT2A 2735/4885
US-20100267699-A1 CHEMICAL COMPOUNDS - 643 AR, KLK3, ESRRA GRM5 1297/4885MEN1 618/4885KMT2A 1460/4885
US-20230035133-A1 [1,2,4]Triazolo[4,3-B]Pyridazines For Use in the Treatment of Proliferative Diseases MKI67, CCNB1, CCNB2 GRM5 3828/4885MEN1 619/4885KMT2A 2735/4885
US-10766905-B2 [1,2,4]triazolo[4,3-B]pyridazines for use in the treatment of proliferative diseases MKI67, CCNB1, CCNB2 GRM5 3828/4885MEN1 619/4885KMT2A 2735/4885
US-20100016279-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS-155 AR, NR5A1, CYP17A1 GRM5 305/4885MEN1 1150/4885KMT2A 3283/4885

“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.