SCHEMBL8472347

SCHEMBL8472347

CC(C1CCCN1)n1c(C(=O)NCCCN2CCCC2=O)c(C(c2ccccc2)c2ccc(OCc3ccccc3)cc2)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.41
RCE1 Q9Y256 1/20 0.41
KDM4E B2RXH2 4/20 0.40
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 4/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 3/20 0.39
MAPK1 P28482 2/20 0.39
CREBBP Q92793 1/20 0.39
TYRO3 Q06418 4/20 0.39
POLB P06746 1/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CHRM4 P08173 1/20 0.38
MEN1 O00255 1/20 0.38
HTR2C P28335 1/20 0.37
HTR2B P41595 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
SCHEMBL8475776 0.91 RCE1 (0.42) SMN1; SMN2RCE1KDM4EKMT2AALDH1A1
Hydrochloric Acid SCHEMBL8474668 0.91 KDM4E (0.42) SMN1; SMN2RCE1KDM4EKMT2AALDH1A1
SCHEMBL8474450 0.88 LMNA (0.47) KDM4EKMT2AALDH1A1HPGDHSD17B10
SCHEMBL8898481 0.87 HTR2C (0.42) SMN1; SMN2KDM4EKMT2AALDH1A1LMNA
SCHEMBL8472339 0.85 SMN1; SMN2 (0.40) SMN1; SMN2RCE1KDM4EKMT2AALDH1A1
SCHEMBL8477072 0.85 GPR88 (0.45) KMT2AALDH1A1CHRM4MEN1HTR2C
SCHEMBL8472000 0.83 HTR2C (0.43) KMT2AALDH1A1CHRM4MEN1HTR2C
SCHEMBL8472345 0.81 SMN1; SMN2 (0.45) SMN1; SMN2RCE1KDM4EKMT2AALDH1A1
SCHEMBL8472479 0.81 SMN1; SMN2 (0.45) SMN1; SMN2RCE1KDM4EKMT2AALDH1A1
SCHEMBL8474902 0.80 SLC6A2 (0.41) SMN1; SMN2POLBLMNAL3MBTL1CHRM4

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