SCHEMBL6673435

SCHEMBL6673435

CCCCCc1c(C2=CC=CC2)ccc2c1Cc1ccccc1-2

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.35
PGR P06401 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
CXCR5 P32302 1/20 0.31
SIGMAR1 Q99720 2/20 0.31
GPR3 P46089 1/20 0.31
CYSLTR2 Q9NS75 4/20 0.30
CYSLTR1 Q9Y271 4/20 0.30
DRD2 P14416 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
SLC6A4 P31645 1/20 0.30

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
SCHEMBL6677845 0.99 PNMT (0.34) PNMTPGRNPC1RAB9ACXCR5
SCHEMBL6672353 0.96 PNMT (0.35) PNMTPGRNPC1RAB9ASIGMAR1
SCHEMBL6671923 0.91 PNMT (0.37) PNMTPGRNPC1RAB9ADRD2
SCHEMBL6673850 0.85 PNMT (0.39) PNMTPGRNPC1RAB9ADRD2
SCHEMBL3425445 0.79 PNMT (0.43) PNMTPGRNPC1RAB9AGPR3
SCHEMBL6759460 0.78 PNMT (0.42) PNMTPGRNPC1RAB9AGPR3
SCHEMBL235556 0.78 PNMT (0.42) PNMTPGRNPC1RAB9AGPR3
SCHEMBL6760396 0.78 PNMT (0.42) PNMTPGRNPC1RAB9AGPR3
SCHEMBL31711756 0.78 PNMT (0.42) PNMTPGRNPC1RAB9AGPR3
SCHEMBL167384 0.78 PNMT (0.42) PNMTPGRNPC1RAB9AGPR3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0963990-B1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed
US-6197990-B1 REACTING CYCLOPENTADIENE AND METAL HYDRIDE IN PRESENCE OF AMINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-03-06 US disclosed
EP-0963990-A1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-15 EP disclosed