SCHEMBL9215152

SCHEMBL9215152

Cc1cc2c(cc1C)CC(=O)N(CC1CCCN(CCc3cc4ccccc4o3)C1)CC2

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.44
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
PKM P14618 1/20 0.39
PDE2A O00408 1/20 0.38
HTR2B P41595 5/20 0.38
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
LTA4H P09960 1/20 0.36
RAB9A P51151 1/20 0.36
DRD2 P14416 2/20 0.36
HRH3 Q9Y5N1 1/20 0.35
MAOA P21397 1/20 0.35

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
SCHEMBL9213117 0.97 MAPK1 (0.42) MAPK1LMNASMN1; SMN2PKMPDE2A
SCHEMBL9207136 0.95 HTR2B (0.39) MAPK1LMNASMN1; SMN2HTR2BHCRTR1
SCHEMBL9214809 0.94 MAPK1 (0.41) MAPK1LMNASMN1; SMN2PKMPDE2A
SCHEMBL9206641 0.94 MAPK1 (0.41) MAPK1LMNASMN1; SMN2PKMPDE2A
SCHEMBL9207394 0.91 HCRTR1 (0.44) MAPK1LMNASMN1; SMN2PKMHTR2B
SCHEMBL9217026 0.90 MAPK1 (0.40) MAPK1LMNASMN1; SMN2PKMPDE2A
SCHEMBL9210489 0.89 HCRTR1 (0.44) MAPK1LMNASMN1; SMN2HTR2BHCRTR1
SCHEMBL9207626 0.88 MAPK1 (0.38) MAPK1LMNASMN1; SMN2PKMPDE2A
SCHEMBL9216985 0.86 HTR2B (0.45) LMNASMN1; SMN2HTR2BHCRTR1HCRTR2
SCHEMBL9210043 0.86 DRD2 (0.44) MAPK1LMNASMN1; SMN2HTR2BHCRTR1

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
EP-0292840-B1 Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation THOMAE GMBH DR K (DE) 1995-08-09 EP disclosed
US-5175157-A Cardiovascular disorders BOEHRINGER INGELHEIM GMBH (DE) 1992-12-29 US disclosed