SCHEMBL6994641

SCHEMBL6994641

NS(=O)(=O)c1cccc2c(Cl)nccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 1/20 0.53
CA2 P00918 5/20 0.50
CA1 P00915 4/20 0.50
CA9 Q16790 3/20 0.50
LMNA P02545 3/20 0.46
MAPK1 P28482 2/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
APEX1 P27695 1/20 0.46
PMP22 Q01453 1/20 0.46
FTO Q9C0B1 1/20 0.45
LDHA P00338 1/20 0.44
CHRM1 P11229 1/20 0.41
NPC1 O15118 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL5007289 0.84 CYP3A4 (0.51) CDK2LMNAMAPK1CYP3A4MAPT
Hydrochloric Acid SCHEMBL5663856 0.83 PMP22 (0.50) CDK2LMNAMAPK1CYP3A4MAPT
SCHEMBL5007156 0.83 TTR (0.51) CDK2LMNAMAPK1CYP3A4MAPT
SCHEMBL10050727 0.83 LMNA (0.46) LMNAMAPK1CYP3A4MAPTAPEX1
Hydrochloric Acid SCHEMBL10824889 0.81 TTR (0.50) CDK2LMNAMAPK1CYP3A4MAPT
SCHEMBL7735396 0.79 CDK2 (0.62) CDK2CA2CA1CA9LMNA
SCHEMBL10019204 0.79 LMNA (0.42) LMNAMAPK1CYP3A4MAPTAPEX1
SCHEMBL9138970 0.79 CDK2 (0.78) CDK2CA2CA1CA9MAPK1
SCHEMBL2909360 0.76 CYP3A4 (0.68) LMNAMAPK1CYP3A4MAPTAPEX1
SCHEMBL1742387 0.76 CA1 (0.56) CA2CA1CA9LMNAMAPK1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1023268-B1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER LTD (GB) 2003-05-21 EP disclosed
US-6403590-B1 Use of certain isoquinolinesulfonyl compounds for the treatment of glaucoma and ocular ischemia ALCON LABORATORIES, INC. 2002-06-11 US disclosed
US-6248738-B1 ANTIULCER AGENTS, ANGIOGENESIS INHIBITORS, ANTIMETASTASIS AGENTS, ANTITUMOR AGENTS PFIZER INC. 2001-06-19 US disclosed
CN-1275979-A Isoquinoline compounds useful as urokinase inhibitors PFIZER (US) 2000-12-06 CN disclosed
EP-1023268-A1 ISOQUINOLINES AS UROKINASE INHIBITORS Pfizer Limited (GB) 2000-08-02 EP disclosed
WO-1999020608-A1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER LIMITED (GB) 1999-04-29 WO disclosed