SCHEMBL22639154

SCHEMBL22639154

Cn1c2ccccc2c2ccc(N3CCc4ccccc4CC3)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.48
KIF11 P52732 1/20 0.45
KHK P50053 2/20 0.43
HPGD P15428 5/20 0.42
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 4/20 0.42
LMNA P02545 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
IP6K1 Q92551 1/20 0.42
IP6K3 Q96PC2 1/20 0.42
HSD17B10 Q99714 3/20 0.41
ATM Q13315 1/20 0.41
HTR3A P46098 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
HTT P42858 2/20 0.40
MAOA P21397 2/20 0.40

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
SCHEMBL31651963 0.82 KHK (0.54) GPR3KIF11KHKHTR3A
SCHEMBL18596811 0.75 ALDH1A1 (0.51) GPR3KIF11HPGDKDM4EALDH1A1
SCHEMBL13241941 0.75 GPR3 (0.61) GPR3KIF11HPGDKDM4EALDH1A1
SCHEMBL17038400 0.74 GPR3 (0.59) GPR3KIF11HPGDKDM4EALDH1A1
SCHEMBL2604404 0.73 GPR3 (0.58) GPR3KIF11HPGDKDM4EALDH1A1
SCHEMBL22549469 0.72 CYP1A2 (0.66) ALDH1A1CYP1A2CYP2D6MAOAMAOB
SCHEMBL17676358 0.71 GPR3 (0.55) GPR3KIF11HPGDKDM4EALDH1A1
SCHEMBL17676398 0.71 GPR3 (0.55) GPR3KIF11HPGDKDM4EALDH1A1
SCHEMBL17904086 0.71 GPR3 (0.55) GPR3KIF11HPGDKDM4EALDH1A1
SCHEMBL13425785 0.71 RXRA (0.40) GPR3KIF11KHKHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10830935-B2 Phase difference plate, circularly polarizing plate, and image display device ZEON CORPORATION (JP) 2020-11-10 US disclosed