SCHEMBL8342001

SCHEMBL8342001

ClC1CN(c2ccccc2)CC(Cl)N1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 1/20 0.53
SIGMAR1 Q99720 2/20 0.43
HTR3E A5X5Y0 1/20 0.43
HTR3B O95264 1/20 0.43
ADRB1 P08588 1/20 0.43
HTR3A P46098 1/20 0.43
HTR3D Q70Z44 1/20 0.43
HTR3C Q8WXA8 1/20 0.43
NOTUM Q6P988 1/20 0.39
LMNA P02545 1/20 0.39
HTR2C P28335 1/20 0.39
SLC6A4 P31645 1/20 0.39
DRD4 P21917 1/20 0.38
KCNH2 Q12809 1/20 0.38
DPP4 P27487 1/20 0.38
DRD2 P14416 2/20 0.37
TSHR P16473 1/20 0.37
MBTD1 Q05BQ5 1/20 0.37
L3MBTL3 Q96JM7 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL236047 0.76 ADRB1 (0.52) BPTFSIGMAR1HTR3EHTR3BADRB1
SCHEMBL19852376 0.76 CHRNB4 (0.57) BPTFSIGMAR1HTR3EHTR3BADRB1
Hydrochloric Acid SCHEMBL27362287 0.75 ADRB1 (0.50) BPTFSIGMAR1HTR3EHTR3BADRB1
Indole SCHEMBL10367462 0.74 TRPA1 (0.45) BPTFHTR2CSLC6A4KCNH2
SCHEMBL19852275 0.74 CHRNB2 (0.62) BPTFSIGMAR1HTR3EHTR3BADRB1
SCHEMBL19839303 0.74 CHRNB2 (0.62) BPTFSIGMAR1HTR3EHTR3BADRB1
SCHEMBL800968 0.74 BPTF (0.53) BPTFSIGMAR1HTR3EHTR3BADRB1
SCHEMBL12663143 0.74 BPTF (0.53) BPTFSIGMAR1HTR3EHTR3BADRB1
SCHEMBL4661349 0.71 PLD1 (0.51) DPP4TSHRCYP3A4CYP2D6MAPK1
SCHEMBL2330436 0.70 BPTF (0.54) BPTFSIGMAR1HTR3EHTR3BADRB1

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-5958923-A TREATMENT OF NERVOUS SYSTEM DISORDERS BASF AKTIENGESELLSCHAFT (DE) 1999-09-28 US disclosed