SCHEMBL10695615

SCHEMBL10695615

COC(=O)c1ccc2c(c1)C(n1ccc(O)cc1=O)=CC(C)(C)O2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
RAB9A P51151 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
MCL1 Q07820 1/20 0.40
CASP3 P42574 1/20 0.36
SMN1; SMN2 Q16637 5/20 0.35
NPC1 O15118 1/20 0.35
ALOX5 P09917 1/20 0.35
CA12 O43570 3/20 0.35
CA9 Q16790 3/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 2/20 0.35
CA14 Q9ULX7 2/20 0.35
XDH P47989 1/20 0.35
RARA P10276 1/20 0.34
RARB P10826 1/20 0.34
RARG P13631 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
SCHEMBL10695963 0.89 ALDH1A1 (0.41) MAPTKMT2ACA12CA9CA1
SCHEMBL10697122 0.88 MAPT (0.34) MAPTRARARARBRARGALDH1A1
SCHEMBL10696935 0.87 MAPT (0.34) MAPTSMN1; SMN2RARARARBRARG
SCHEMBL10697007 0.86 RARA (0.38) MAPTSMN1; SMN2RARARARBRARG
SCHEMBL7268034 0.86 ALOX5 (0.40) MAPTRAB9AMEN1KMT2APOLB
SCHEMBL9377257 0.80 RAB9A (0.39) MAPTRAB9AMEN1KMT2APOLB
SCHEMBL8084285 0.80 RAB9A (0.39) MAPTRAB9AMEN1KMT2APOLB
SCHEMBL10697804 0.79 MAPT (0.34) MAPTALDH1A1KDM4E
SCHEMBL7269375 0.79 PDE4A (0.42) MAPTCASP3LMNAKDM4E
SCHEMBL9733491 0.79 CASP3 (0.36) MAPTRAB9AMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0273262-A2 Chroman derivatives MERCK PATENT GmbH (DE) 1988-07-06 EP disclosed