SCHEMBL1783498

SCHEMBL1783498

CCNc1ccc(C(=O)C2=C(O)c3sc(NC(C)=O)nc3CC2)cn1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 4/20 0.43
PIK3CG P48736 6/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
OGA O60502 6/20 0.34
NPC1 O15118 1/20 0.33
STAT1 P42224 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL1117865 0.91 HCAR3 (0.42) HCAR3PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL1117941 0.91 HCAR3 (0.41) HCAR3PIK3CGNPC1RAB9ASMN1; SMN2
SCHEMBL1117883 0.91 HCAR3 (0.41) HCAR3PIK3CGNPC1RAB9ASMN1; SMN2
SCHEMBL1784359 0.89 HCAR3 (0.40) HCAR3PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL1783449 0.89 HCAR3 (0.45) HCAR3PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL1117879 0.89 HCAR3 (0.40) HCAR3NPC1RAB9ASMN1; SMN2
SCHEMBL1780133 0.88 HCAR3 (0.39) HCAR3PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL1781674 0.88 HCAR3 (0.47) HCAR3PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL1783723 0.88 OGA (0.34) HCAR3PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL27857536 0.88 HCAR3 (0.39) HCAR3NPC1STAT1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304556-B2 Thiazolyl-dihydro-indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-06 US disclosed
US-8304556-B2 Thiazolyl-dihydro-indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-06 US disclosed
US-20120108567-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-03 US disclosed
US-20120108567-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-03 US disclosed
US-20110118208-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-19 US disclosed
US-20110118208-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-19 US disclosed
CN-102015728-A Thiazolyl-dihydro-indazoles BOEHRINGER INGELHEIM INT 2011-04-13 CN disclosed
WO-2009112565-A1 THIAZOLYL-DIHYDRO-INDAZOLES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-17 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 (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-20120108567-A1 Thiazolyl-Dihydro-Indazoles MKI67, CYP11B1, IGF1R HCAR3 2774/4885PIK3CG 4280/4885PIK3CD 3523/4885
US-20110118208-A1 Thiazolyl-Dihydro-Indazoles MKI67, CYP11B1, IGF1R HCAR3 2774/4885PIK3CG 4280/4885PIK3CD 3523/4885

“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.