SCHEMBL8476307

SCHEMBL8476307

CN(C)CCOc1ccc(C(c2ccccc2)c2c(C(=O)NCCCN3CCCC3=O)n(CCN(C)C)c3ccccc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 3/20 0.43
HPGD P15428 2/20 0.43
MAPK1 P28482 2/20 0.43
CREBBP Q92793 1/20 0.43
RCE1 Q9Y256 1/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 3/20 0.42
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
MEN1 O00255 1/20 0.40

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
SCHEMBL8472479 0.93 SMN1; SMN2 (0.45) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8477086 0.93 KDM4E (0.49) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
Hydrochloric Acid SCHEMBL8476877 0.92 KDM4E (0.49) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8472034 0.91 SMN1; SMN2 (0.46) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
Hydrochloric Acid SCHEMBL8476546 0.90 KDM4E (0.46) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8477848 0.89 ALDH1A1 (0.47) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8474096 0.89 KDM4E (0.49) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8474623 0.88 KDM4E (0.48) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8475772 0.88 SMN1; SMN2 (0.46) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD
SCHEMBL8476437 0.85 KDM4E (0.39) SMN1; SMN2KDM4EALDH1A1POLBRAB9A

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