SCHEMBL6677845

SCHEMBL6677845

CCCCCCc1c(C2=CC=CC2)ccc2c1Cc1ccccc1-2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.34
PGR P06401 1/20 0.33
GPR3 P46089 1/20 0.33
CYSLTR2 Q9NS75 4/20 0.32
CYSLTR1 Q9Y271 4/20 0.32
DRD2 P14416 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
SLC6A4 P31645 1/20 0.32
PTPN1 P18031 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
CXCR5 P32302 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL6673435 0.99 PNMT (0.35) PNMTPGRGPR3CYSLTR2CYSLTR1
SCHEMBL6672353 0.95 PNMT (0.35) PNMTPGRDRD2NPC1RAB9A
SCHEMBL6671923 0.90 PNMT (0.37) PNMTPGRDRD2ALDH1A1NPC1
SCHEMBL6673850 0.84 PNMT (0.39) PNMTPGRDRD2ALDH1A1CYP1A2
SCHEMBL31711756 0.79 PNMT (0.42) PNMTPGRGPR3CYSLTR2CYSLTR1
SCHEMBL6759460 0.79 PNMT (0.42) PNMTPGRGPR3CYSLTR2CYSLTR1
SCHEMBL167384 0.79 PNMT (0.42) PNMTPGRGPR3CYSLTR2CYSLTR1
SCHEMBL6758782 0.79 PNMT (0.42) PNMTPGRGPR3CYSLTR2CYSLTR1
SCHEMBL6760396 0.79 PNMT (0.42) PNMTPGRGPR3CYSLTR2CYSLTR1
SCHEMBL235556 0.79 PNMT (0.42) PNMTPGRGPR3CYSLTR2CYSLTR1

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