SCHEMBL6561469

SCHEMBL6561469

CC1=C2CCC3=C(C)c4ccccc4C3CCC2c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
GPR3 P46089 1/20 0.33
PDPK1 O15530 1/20 0.32
HTR2C P28335 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL3255766 0.92 DDB1 (0.38) DDB1CRBNGPR3PDPK1HTR2C
SCHEMBL3248563 0.90 DDB1 (0.37) DDB1CRBNGPR3PDPK1HTR2C
SCHEMBL11823518 0.77 TAAR1 (0.44) HTR2C
SCHEMBL5819529 0.75 DRD1 (0.43) CYP2D6
Hydrochloric Acid SCHEMBL5603824 0.73 ADRA2C (0.33) GPR3
Hydrochloric Acid SCHEMBL15674867 0.69 PARP1 (0.31)
SCHEMBL673933 0.69 CYP11B2 (0.35)
SCHEMBL3287343 0.68 DDB1 (0.39) DDB1CRBNPDPK1HTR2C
SCHEMBL13934676 0.66 MEN1 (0.36) CYP1A2
SCHEMBL9789468 0.66 CYP1A2 (0.36) DDB1CRBNGPR3PDPK1CYP1A2

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-0818458-B1 TRANSITION METAL COMPOUND, POLYMERIZATION CATALYST FOR OLEFINS, AND PROCESS FOR PRODUCING OLEFINIC POLYMERS IDEMITSU KOSAN CO (JP) 2004-02-25 EP disclosed
US-6339135-B1 AS POLYMERIZATION CATALYST IDEMITSU KOSAN CO., LTD. (JP) 2002-01-15 US disclosed
EP-0818458-A1 TRANSITION METAL COMPOUND, POLYMERIZATION CATALYST FOR OLEFINS, AND PROCESS FOR PRODUCING OLEFINIC POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-01-14 EP disclosed