SCHEMBL8476897

SCHEMBL8476897

Cc1ccc(C(c2ccc(C)cc2)c2c(C(=O)NCCCN3CCOCC3)n(CCN(C)C)c3ccccc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
MAPK1 P28482 2/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 0.48
KMT2A Q03164 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.45
HTT P42858 3/20 0.45
MEN1 O00255 3/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
RAD52 P43351 1/20 0.45
TSHR P16473 1/20 0.44

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
SCHEMBL8476333 0.94 KDM4E (0.49) ALDH1A1KDM4EMAPK1HPGDALOX15
SCHEMBL8477583 0.93 ALDH1A1 (0.46) ALDH1A1KDM4EMAPK1HPGDALOX15
SCHEMBL8472285 0.93 ALDH1A1 (0.52) ALDH1A1KDM4EMAPK1HPGDALOX15
SCHEMBL8471992 0.93 KMT2A (0.47) ALDH1A1KDM4EMAPK1HPGDALOX15
SCHEMBL8472581 0.92 KDM4E (0.46) ALDH1A1KDM4EMAPK1HPGDALOX15
SCHEMBL8472597 0.91 ALDH1A1 (0.50) ALDH1A1KDM4EMAPK1HPGDALOX15
SCHEMBL8899446 0.90 ALDH1A1 (0.49) ALDH1A1KDM4EMAPK1HPGDALOX15
SCHEMBL8476916 0.88 KDM4E (0.43) ALDH1A1KDM4EMAPK1HPGDALOX15
SCHEMBL8477752 0.88 HPGD (0.46) ALDH1A1KDM4EMAPK1HPGDALOX15
SCHEMBL8477279 0.87 LMNA (0.51) ALDH1A1KDM4EMAPK1HPGDALOX15

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