SCHEMBL27635237

SCHEMBL27635237

CCC(=O)c1cc2ccccc2cc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.58
KMT2A Q03164 8/20 0.58
MAPT P10636 3/20 0.58
MITF O75030 1/20 0.58
GAA P10253 1/20 0.58
NCOA1 Q15788 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
NCOA3 Q9Y6Q9 1/20 0.58
HSP90AB1 P08238 1/20 0.56
CA9 Q16790 1/20 0.55
HMGCR P04035 1/20 0.53
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
CASP1 P29466 1/20 0.51
CASP7 P55210 1/20 0.51
POLB P06746 5/20 0.50
NPC1 O15118 4/20 0.50
RAB9A P51151 4/20 0.50
MAPK1 P28482 1/20 0.50
APOBEC3A P31941 1/20 0.50

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
SCHEMBL29254632 0.81 SMN1; SMN2 (0.47) MEN1KMT2AMAPTMITFGAA
SCHEMBL11263612 0.81 IDO1 (0.53) MAPTHSP90AB1CA9KDM4EALDH1A1
SCHEMBL23643783 0.81 MAPT (0.58) MEN1KMT2AMAPTMITFGAA
SCHEMBL27888697 0.79 ALDH1A1 (0.43) MEN1KMT2AMAPTMITFGAA
SCHEMBL4050618 0.79 MEN1 (0.61) MEN1KMT2AMAPTMITFGAA
SCHEMBL30137706 0.78 MEN1 (0.58) MEN1KMT2AMAPTMITFGAA
SCHEMBL27451059 0.78 GRIN2D (0.63) MEN1KMT2AMAPTMITFGAA
SCHEMBL3893085 0.78 MEN1 (0.58) MEN1KMT2AMAPTMITFGAA
SCHEMBL11695943 0.78 MEN1 (0.50) MEN1KMT2AMAPTMITFGAA
SCHEMBL2988486 0.77 ALOX15 (0.69) MEN1KMT2AMAPTTDP1HSP90AB1

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
CN-1688549-A Compound having TGF-beta inhibitory activity and medicinal composition containing the same KIRIN BREWERY (JP) 2005-10-26 CN disclosed