SCHEMBL8476779

SCHEMBL8476779

CCCc1ccc(NC(=O)c2[nH]c3ccccc3c2C(c2ccccc2)c2ccc(OCCC3CCCN3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
APOBEC3A P31941 1/20 0.40
CASP6 P55212 1/20 0.40
KMT2A Q03164 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
GPR88 Q9GZN0 3/20 0.39
MCL1 Q07820 1/20 0.38
GHSR Q92847 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
SCHEMBL8472669 0.86 GPR88 (0.43) MEN1POLBAPOBEC3ACASP6KMT2A
SCHEMBL8472465 0.86 MEN1 (0.45) MEN1POLBAPOBEC3ACASP6KMT2A
SCHEMBL8476781 0.85 EPHX2 (0.48) MEN1POLBAPOBEC3ACASP6KMT2A
SCHEMBL8472656 0.84 MEN1 (0.56) MEN1POLBAPOBEC3ACASP6KMT2A
SCHEMBL8475715 0.83 MEN1 (0.44) MEN1POLBAPOBEC3ACASP6KMT2A
SCHEMBL8471933 0.83 MAPK1 (0.37) GPR88GHSR
SCHEMBL8472278 0.83 POLB (0.43) MEN1POLBAPOBEC3ACASP6KMT2A
SCHEMBL8472570 0.82 MEN1 (0.44) MEN1POLBAPOBEC3ACASP6KMT2A
SCHEMBL8472240 0.77 SMN1; SMN2 (0.42) MEN1POLBAPOBEC3ACASP6KMT2A
Hydrochloric Acid SCHEMBL8472761 0.74

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