SCHEMBL7975685

SCHEMBL7975685

COC(=O)c1[nH]nc(-c2ccc(Br)cc2)c1OCc1ccc(C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.41
TP53 P04637 2/20 0.41
RAB9A P51151 2/20 0.40
POLB P06746 2/20 0.40
ALPL P05186 1/20 0.40
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ANO1 Q5XXA6 1/20 0.39
LMNA P02545 1/20 0.39
ALDH1A1 P00352 3/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
DUSP3 P51452 1/20 0.38
SMPD1 P17405 1/20 0.38
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL10172559 0.90 GAA (0.44) MAPTTP53RAB9AALPLKMT2A
SCHEMBL16258984 0.89 LMNA (0.43) MAPTTP53RAB9APOLBALPL
SCHEMBL20307795 0.79 NPC1 (0.46) MAPTTP53RAB9APOLBALPL
SCHEMBL10140899 0.79 MAOB (0.46) MAPTTP53RAB9APOLBMEN1
SCHEMBL10140911 0.77 MAPT (0.41) MAPTTP53RAB9APOLBTHRA
SCHEMBL11070855 0.77 RAB9A (0.50) MAPTTP53RAB9APOLBALPL
SCHEMBL7978314 0.73 KDM4C (0.53) MAPTRAB9APOLBALPLMEN1
SCHEMBL23115819 0.71 ALDH1A1 (0.56) MAPTRAB9APOLBMEN1KMT2A
SCHEMBL19715740 0.70 RAB9A (0.48) MAPTTP53RAB9APOLBALPL
SCHEMBL14712058 0.69 HSP90AA1 (0.56) MAPTTP53RAB9APOLBALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148363-B2 Heterocyclic compounds as factor IXA inhibitors SCHERING CORPORATION (US) 2012-04-03 US disclosed
US-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-17 US disclosed
WO-2009143039-A2 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS SCHERING CORPORATION (US) 2009-11-26 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 (1 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-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS F9, F12, F8 MAPT 4510/4885TP53 4367/4885RAB9A 400/4885

“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.