SCHEMBL8474450

SCHEMBL8474450

CC(C1CCCN1)n1c(C(=O)NCCCN2CCOCC2)c(C(c2ccccc2)c2ccc(OCc3ccccc3)cc2)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
PKM P14618 1/20 0.47
TACR2 P21452 11/20 0.43
CHRM4 P08173 1/20 0.38
POLB P06746 1/20 0.38
EGFR P00533 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL8472210 0.92 KDM4E (0.43) LMNAPOLBKDM4EALDH1A1HPGD
SCHEMBL8476838 0.91 KDM4E (0.40) LMNAPOLBKDM4EALDH1A1HPGD
SCHEMBL8472588 0.89 ALDH1A1 (0.43) LMNAKDM4EALDH1A1HPGDALOX15
SCHEMBL8472347 0.88 SMN1; SMN2 (0.41) LMNACHRM4POLBHTR2CHTR2B
SCHEMBL8898481 0.88 HTR2C (0.42) LMNACHRM4HTR2CHTR2BKDM4E
SCHEMBL8474453 0.86 LMNA (0.49) LMNAMAPTPKMTACR2POLB
SCHEMBL8477072 0.86 GPR88 (0.45) CHRM4HTR2CHTR2BALDH1A1ALOX15
SCHEMBL8472000 0.83 HTR2C (0.43) CHRM4HTR2CHTR2BALDH1A1ALOX15
SCHEMBL8474454 0.83 LMNA (0.53) LMNAMAPTPKMTACR2POLB
SCHEMBL8475953 0.81 KDM4E (0.44) LMNAMAPTPKMKDM4EALDH1A1

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