SCHEMBL506790

SCHEMBL506790

CCOc1ccc(CN)cc1Cl

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 8/20 0.75
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 1/20 0.55
GLA P06280 1/20 0.54
MRGPRX4 Q96LA9 1/20 0.51
MAPT P10636 2/20 0.47
RORC P51449 1/20 0.47
RAB9A P51151 1/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
USP2 O75604 1/20 0.47
CSNK2A2 P19784 1/20 0.45
CSNK2B P67870 1/20 0.45
CSNK2A3 Q8NEV1 1/20 0.45
BACE1 P56817 1/20 0.44

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
Hydrochloric Acid SCHEMBL3110229 0.98 CSNK2A1 (0.76) CSNK2A1SMN1; SMN2LMNAGLAMRGPRX4
SCHEMBL6939966 0.85 CSNK2A1 (0.56) CSNK2A1SMN1; SMN2LMNAMRGPRX4MAPT
SCHEMBL12503974 0.85 CSNK2A1 (0.54) CSNK2A1SMN1; SMN2LMNAGLAMAPT
SCHEMBL10088645 0.83 CSNK2A1 (0.53) CSNK2A1SMN1; SMN2LMNAGLAMAPT
SCHEMBL5240461 0.82 CSNK2A1 (0.51) CSNK2A1SMN1; SMN2LMNAMAPT
SCHEMBL11013100 0.81 CSNK2A1 (0.51) CSNK2A1SMN1; SMN2LMNAGLAMAPT
SCHEMBL13614242 0.81 SMN1; SMN2 (0.58) CSNK2A1SMN1; SMN2LMNAGLAMAPT
SCHEMBL3718539 0.81 RAB9A (0.56) CSNK2A1SMN1; SMN2LMNAGLAMRGPRX4
SCHEMBL3721818 0.81 CSNK2A1 (0.51) CSNK2A1SMN1; SMN2LMNAGLAMAPT
SCHEMBL16960578 0.81 CSNK2A1 (0.51) CSNK2A1SMN1; SMN2LMNAGLAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2886540-B1 BICYCLIC SUBSTITUTED PYRIMIDINE COMPOUNDS XUANZHU PHARMA CO LTD (CN) 2017-07-26 EP disclosed
US-9359371-B2 Bicyclic substituted pyrimidine compounds Xuanzhu Pharma Co., Ltd. (CN) 2016-06-07 US disclosed
US-20150232474-A1 Bicyclic Substituted Pyrimidine Compounds Xuanzhu Biopharmaceutical Co., Ltd. (CN) 2015-08-20 US disclosed
EP-2886540-A1 BICYCLIC SUBSTITUTED PYRIMIDINE COMPOUNDS Xuanzhu Pharma Co., Ltd. (CN) 2015-06-24 EP disclosed
EP-1720836-B1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO [D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS LILLY CO ELI (US) 2014-04-16 EP disclosed
EP-1720836-B1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO [D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS LILLY CO ELI (US) 2014-04-16 EP disclosed
US-8580780-B2 6 substituted 2, 3,4,5 tetrahydro-1H-benzo[d]azepines as 5-HT2C receptor agonist ELI LILLY AND COMPANY (US) 2013-11-12 US disclosed
US-8580780-B2 6 substituted 2, 3,4,5 tetrahydro-1H-benzo[d]azepines as 5-HT2C receptor agonist ELI LILLY AND COMPANY (US) 2013-11-12 US disclosed
US-8580780-B2 6 substituted 2, 3,4,5 tetrahydro-1H-benzo[d]azepines as 5-HT2C receptor agonist ELI LILLY AND COMPANY (US) 2013-11-12 US disclosed
US-20130029942-A1 COMPOUNDS AND THERAPEUTICAL USES THEREOF MYREXIS, INC. (US) 2013-01-31 US disclosed
WO-2002045716-A1 USE OF PYRAZOLO[4,3-D]PYRIMIDINES MERCK PATENT GMBH (DE) 2002-06-13 WO disclosed
EP-1212062-A1 USE OF THIENOPYRIMIDINES MERCK PATENT GmbH (DE) 2002-06-12 EP disclosed
EP-1210349-A2 PYRAZOLO 4,3-d]PYRIMIDINES MERCK PATENT GmbH (DE) 2002-06-05 EP disclosed
WO-2002041880-A2 USE OF PYRAZOLO[4,3-D]PYRIMIDINES MERCK PATENT GMBH (DE) 2002-05-30 WO disclosed
WO-2001064192-A2 USE OF BENZOTHIENO-2,3-D-PYRIMIDINES WITH PDE V INHIBITORY EFFECT FOR THE TREATMENT OF ERECTILE DYSFUNCTION MERCK PATENT GMBH (DE) 2001-09-07 WO disclosed
WO-2001019369-A1 USE OF THIENOPYRIMIDINES MERCK PATENT GMBH (DE) 2001-03-22 WO disclosed
EP-1084125-A1 CONDENSED THIENOPYRIMIDINES WITH PHOSPHODIESTERASE-V INHIBITING ACTION MERCK PATENT GmbH (DE) 2001-03-21 EP disclosed
WO-2001018004-A2 PYRAZOLO[4,3-d]PYRIMIDINES MERCK PATENT GMBH (DE) 2001-03-15 WO disclosed
WO-1999055708-A1 CONDENSED THIENOPYRIMIDINES WITH PHOSPHODIESTERASE-V INHIBITING ACTION MERCK PATENT GMBH (DE) 1999-11-04 WO disclosed
EP-0686625-A1 ANTHRANILIC ACID DERIVATIVE Eisai Co., Ltd. (JP) 1995-12-13 EP 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 (2 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-20130029942-A1 COMPOUNDS AND THERAPEUTICAL USES THEREOF BAD, CASP3, BAX CSNK2A1 2281/4885SMN1; SMN2 1368/4885LMNA 940/4885
US-20150232474-A1 Bicyclic Substituted Pyrimidine Compounds DPYD, UMPS, TYMP CSNK2A1 3501/4885SMN1; SMN2 637/4885LMNA 3806/4885

“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.