SCHEMBL6673850

SCHEMBL6673850

CCc1c(C2=CC=CC2)ccc2c1Cc1ccccc1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.39
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
PGR P06401 1/20 0.34
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32
SRD5A2 P31213 1/20 0.32
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 2/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.31
ATM Q13315 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 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
SCHEMBL6671923 0.89 PNMT (0.37) PNMTNPC1RAB9APGRDRD2
SCHEMBL6672353 0.87 PNMT (0.35) PNMTNPC1RAB9APGRDRD2
SCHEMBL6673435 0.85 PNMT (0.35) PNMTNPC1RAB9APGRDRD2
SCHEMBL6677845 0.84 PNMT (0.34) PNMTNPC1RAB9APGRDRD2
SCHEMBL27348144 0.82 PNMT (0.45) PNMTNPC1RAB9APGRDRD2
Hydrochloric Acid SCHEMBL27650656 0.81 PNMT (0.36) PNMTNPC1RAB9APGRDRD2
Hydrochloric Acid SCHEMBL8564075 0.81 NPC1 (0.35) PNMTNPC1RAB9APGRDRD2
SCHEMBL6657518 0.81 PNMT (0.33) PNMTNPC1RAB9APGRSRD5A2
SCHEMBL723321 0.81 PNMT (0.40) PNMTNPC1RAB9APGRDRD2
SCHEMBL28286932 0.80 PNMT (0.44) PNMTNPC1RAB9APGRDRD2

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