SCHEMBL29335353

SCHEMBL29335353

COc1ccc(N(Cc2ccc(F)cc2)C(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.51
S1PR1 P21453 1/20 0.47
MAPK1 P28482 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TAS2R14 Q9NYV8 1/20 0.46
APLNR P35414 4/20 0.45
ALDH1A1 P00352 1/20 0.43
MITF O75030 1/20 0.43
LMNA P02545 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
GPR35 Q9HC97 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
XBP1 P17861 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL20871285 0.92 TAAR1 (0.57) TAAR1APLNRALDH1A1CNR1CNR2
SCHEMBL29336140 0.87 MAPK1 (0.44) TAAR1MAPK1MEN1KMT2AKDM4E
SCHEMBL20871284 0.86 TAAR1 (0.52) TAAR1MAPTAPLNRALDH1A1LMNA
SCHEMBL22340686 0.86 TAAR1 (0.52) TAAR1MAPTAPLNRALDH1A1LMNA
SCHEMBL29335354 0.84 BCL2A1 (0.52) TAAR1MEN1KMT2AAPLNRALDH1A1
SCHEMBL20871276 0.84 TAAR1 (0.51) TAAR1MAPK1MEN1KMT2AMAPT
SCHEMBL22340682 0.84 TAAR1 (0.51) TAAR1APLNRALDH1A1CNR1CNR2
SCHEMBL22340950 0.84 KMT2A (0.45) TAAR1S1PR1MAPK1MEN1KMT2A
SCHEMBL11669812 0.84 TAAR1 (0.54) TAAR1MAPK1MEN1KMT2AL3MBTL1
SCHEMBL29335366 0.84 MEN1 (0.50) TAAR1MEN1KMT2AAPLNRALDH1A1

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
EP-3707132-B1 NEW METHOD FOR THE SYNTHESIS OF UNSYMMETRICAL TERTIARY AMINES UNIV PARIS SACLAY (FR) 2024-07-17 EP disclosed