SCHEMBL8946264

SCHEMBL8946264

COc1c(C)c(C)c2[nH]c3c(c2c1C)Cc1ccccc1-3

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 7/20 0.43
CA2 P00918 7/20 0.43
CA4 P22748 7/20 0.43
CA6 P23280 7/20 0.43
HIF1A Q16665 3/20 0.38
KDR P35968 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PGR P06401 1/20 0.33
NTRK1 P04629 1/20 0.32
MAP3K9 P80192 1/20 0.32
MAP3K10 Q02779 1/20 0.32
MAP3K11 Q16584 1/20 0.32
PDGFRB P09619 1/20 0.32

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
SCHEMBL8946827 0.79 CA1 (0.48) CA1CA2CA4CA6HIF1A
SCHEMBL9531330 0.77 CA1 (0.49) CA1CA2CA4CA6HIF1A
SCHEMBL9526355 0.76 CA1 (0.43) CA1CA2CA4CA6HIF1A
SCHEMBL10381644 0.70 CA1 (0.41) CA1CA2CA4CA6HIF1A
SCHEMBL8946893 0.69 CA1 (0.52) CA1CA2CA4CA6HIF1A
SCHEMBL9527337 0.68 CA1 (0.44) CA1CA2CA4CA6HIF1A
SCHEMBL14447191 0.67 CA1 (0.53) CA1CA2CA4CA6KDR
SCHEMBL9528764 0.67 CA1 (0.53) CA1CA2CA4CA6HIF1A
SCHEMBL9531171 0.65 CA1 (0.40) CA1CA2CA4CA6KDR
SCHEMBL9527328 0.65 CA1 (0.50) CA1CA2CA4CA6KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5516788-A TREATMENT OF ATHEROSCLEROSIS; ANTIISCHEMIC, ANTICARCINOGENIC AGENTS; ANTICOAGULANTS UNIVERSITY OF BATH (GB) 1996-05-14 US disclosed
EP-0481708-A1 Indenoindole compounds UNIVERSITY OF BATH (GB) 1992-04-22 EP disclosed