SCHEMBL7302332

SCHEMBL7302332

Nc1ccc(N2CCC(N3CCC(c4ccccc4)CC3)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.58
L3MBTL3 Q96JM7 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MBTD1 Q05BQ5 1/20 0.55
GRIN2B Q13224 4/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C19 P33261 1/20 0.55
ESRRB O95718 1/20 0.47
ESRRG P62508 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HDAC4 P56524 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
DHFR P00374 1/20 0.44
GFER P55789 1/20 0.44

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
SCHEMBL241159 0.91 DHFR (0.50) SLC18A3L3MBTL1GRIN2BKMT2ASMN1; SMN2
SCHEMBL7302753 0.85 SLC18A3 (0.58) SLC18A3L3MBTL3L3MBTL1MBTD1GRIN2B
SCHEMBL16763481 0.84 SLC18A3 (0.47) SLC18A3L3MBTL3L3MBTL1MBTD1GRIN2B
SCHEMBL29449720 0.82 MAPT (0.53) SLC18A3L3MBTL3L3MBTL1KMT2ASMN1; SMN2
SCHEMBL6613474 0.81 SMPD3 (0.47) SLC18A3L3MBTL1CYP2C19HPGDKMT2A
SCHEMBL7301802 0.80 TRPV6 (0.59) SLC18A3L3MBTL3L3MBTL1MBTD1GRIN2B
SCHEMBL2236451 0.79 L3MBTL3 (0.81) L3MBTL3L3MBTL1MBTD1KMT2AKDM4E
SCHEMBL3515888 0.79 SLC18A3 (0.60) SLC18A3GRIN2BCYP2D6CYP2C19ESRRB
SCHEMBL7446491 0.79 MBTD1 (0.55) SLC18A3L3MBTL3L3MBTL1MBTD1GRIN2B
SCHEMBL2965273 0.79 SLC18A3 (0.81) SLC18A3GRIN2BCYP2D6CYP2C19HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0503411-B1 Substituted N-phenylpiperidines and medicaments thereof BASF AG (DE) 1995-11-29 EP disclosed
US-5296485-A Substituted N-phenylpiperidines and drugs therefrom BASF AKTIENGESELLSCHAFT (DE) 1994-03-22 US disclosed