SCHEMBL759896

SCHEMBL759896

COC(=O)c1cc(B2OC(C)(C)C(C)(C)O2)cc2cnn(Cc3ccc(OC)cc3)c12

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.56
NPBWR1 P48145 8/20 0.39
HIF1A Q16665 1/20 0.36
BRD4 O60885 1/20 0.36
FAAH O00519 1/20 0.36
SNCA P37840 1/20 0.36
MAPK1 P28482 2/20 0.35
MAPT P10636 1/20 0.35
MCHR1 Q99705 1/20 0.35
PKM P14618 1/20 0.35
PKLR P30613 1/20 0.35
CACNA1H O95180 2/20 0.35
ADORA1 P30542 1/20 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
SCHEMBL14404327 0.91 UCHL1 (0.46) UCHL1HIF1AFAAHMAPTADORA1
SCHEMBL21458253 0.89 UCHL1 (0.44) UCHL1NPBWR1FAAH
SCHEMBL12456444 0.88 UCHL1 (0.45) UCHL1NPBWR1BRD4FAAHMAPK1
SCHEMBL24784632 0.82 UCHL1 (0.41) UCHL1SNCA
SCHEMBL30018541 0.82 UCHL1 (0.41) UCHL1SNCA
SCHEMBL1079965 0.81 UCHL1 (0.35) UCHL1
SCHEMBL759935 0.80 NPBWR1 (0.44) UCHL1NPBWR1BRD4MCHR1PKM
SCHEMBL760501 0.79 UCHL1 (0.45) UCHL1HIF1ASNCACACNA1H
SCHEMBL31357429 0.78 UCHL1 (0.53) UCHL1NPBWR1BRD4SNCAMCHR1
SCHEMBL24996627 0.78 UCHL1 (0.53) UCHL1NPBWR1BRD4SNCAMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
WO-2007117465-A2 INDAZOLE COMPOUNDS ABBOTT LABORATORIES (US) 2007-10-18 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-20070282101-A1 Indazole compounds CYP3A43, CYP3A7, UGT1A1 UCHL1 4282/4885NPBWR1 4290/4885HIF1A 2537/4885
US-20120053345-A1 Indazole Compounds CYP3A43, CYP3A7, UGT1A1 UCHL1 4282/4885NPBWR1 4290/4885HIF1A 2537/4885

“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.