SCHEMBL8475715

SCHEMBL8475715

CCCc1ccc(NC(=O)c2[nH]c3ccccc3c2C(c2ccccc2)c2ccc(OCCN(C)C)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
POLB P06746 3/20 0.44
APOBEC3A P31941 1/20 0.44
CASP6 P55212 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
MCL1 Q07820 3/20 0.42
IMPDH2 P12268 1/20 0.40
AURKA O14965 1/20 0.39
AURKB Q96GD4 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
ABCG2 Q9UNQ0 2/20 0.39
SERPINE1 P05121 2/20 0.39
MCHR1 Q99705 1/20 0.39
LTA4H P09960 1/20 0.38
ESR1 P03372 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL8476781 0.86 EPHX2 (0.48) MEN1KMT2APOLBAPOBEC3ACASP6
SCHEMBL8476135 0.85 POLB (0.48) MEN1KMT2APOLBAPOBEC3ACASP6
SCHEMBL8475163 0.83 MEN1 (0.50) MEN1KMT2APOLBAPOBEC3ACASP6
SCHEMBL8476779 0.83 MEN1 (0.40) MEN1KMT2APOLBAPOBEC3ACASP6
SCHEMBL8472187 0.82 MEN1 (0.62) MEN1KMT2APOLBAPOBEC3ACASP6
SCHEMBL8472895 0.81 HTR6 (0.55) MEN1KMT2APOLBAPOBEC3ACASP6
SCHEMBL8472024 0.80 AURKA (0.41) AURKAAURKBHRH3MCHR1ESR1
SCHEMBL8473549 0.78 POLB (0.45) MEN1KMT2APOLBAPOBEC3ACASP6
SCHEMBL8471948 0.74 SMN1; SMN2 (0.47) MEN1KMT2APOLBAPOBEC3ACASP6
SCHEMBL8473687 0.73 LTA4H (0.44) MEN1KMT2APOLBLTA4H

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-5891902-A OSTEOPOROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-04-06 US disclosed
EP-0782989-A1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-07-09 EP disclosed