SCHEMBL8530744

SCHEMBL8530744

C=C(c1cc(Cl)ccc1O)c1cc2ccccc2n1C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.47
MAPT P10636 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
RECQL P46063 1/20 0.44
DAO P14920 1/20 0.43
SLC9A1 P19634 1/20 0.41
UTS2R Q9UKP6 1/20 0.40
KDM4C Q9H3R0 1/20 0.39
PHGDH O43175 1/20 0.39

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
SCHEMBL8532366 0.84 MCL1 (0.53) MCL1MAPTKDM4EMEN1KMT2A
SCHEMBL8531587 0.84 MCL1 (0.47) MCL1MAPTKDM4EMEN1KMT2A
SCHEMBL8531608 0.79 MCL1 (0.46) MCL1MAPTKDM4EMEN1KMT2A
SCHEMBL3275631 0.79 MCL1 (0.65) MCL1MAPTKDM4EMEN1KMT2A
SCHEMBL8534428 0.76 SRD5A2 (0.57) MCL1MEN1KMT2A
SCHEMBL8532179 0.76 MCL1 (0.47) MCL1MAPTKDM4EMEN1KMT2A
SCHEMBL8535826 0.71 MCL1 (0.44) MCL1MAPTKDM4EMEN1KMT2A
SCHEMBL7981184 0.71 MCL1 (0.62) MCL1MAPTKDM4EMEN1KMT2A
SCHEMBL8253276 0.71 MCL1 (0.68) MCL1MAPTKDM4EMEN1KMT2A
SCHEMBL8616489 0.70 MCL1 (0.53) MCL1MAPTKDM4EMEN1KMT2A

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
US-5728709-A COAGULANTS AND ANTITUMOR AGENTS KYOWA HAKKO KOGYO CO., LTD. (JP) 1998-03-17 US disclosed