SCHEMBL31704883

SCHEMBL31704883

C[C@H](N)c1ccc(C(F)(F)F)cc1Br

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 7/20 0.46
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.36
LMNA P02545 2/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
DPP7 Q9UHL4 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MBOAT4 Q96T53 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
MAPT P10636 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CFTR P13569 1/20 0.33

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
SCHEMBL31706720 1.00 PDE2A (0.46) PDE2AHTR2AHTR2CHTR2BSCN10A
SCHEMBL8389283 0.85 PDE2A (0.49) PDE2AHTR2AHTR2CHTR2BALDH1A1
Hydrochloric Acid SCHEMBL29072767 0.84 PDE2A (0.41) PDE2AHTR2AHTR2CHTR2BSCN10A
Hydrochloric Acid SCHEMBL30117081 0.84 PDE2A (0.41) PDE2AHTR2AHTR2CHTR2BSCN10A
SCHEMBL27877627 0.83 PDE2A (0.47) PDE2AHTR2AHTR2CHTR2BHTT
SCHEMBL2481758 0.81 PDE2A (0.64) PDE2AHTR2AHTR2CHTR2BSCN10A
SCHEMBL27850851 0.81 PDE2A (0.64) PDE2AHTR2AHTR2CHTR2BSCN10A
SCHEMBL21180449 0.81 PDE2A (0.49) PDE2AHTR2AHTR2CHTR2BSCN10A
SCHEMBL29472439 0.81 PDE2A (0.49) PDE2AHTR2AHTR2CHTR2BSCN10A
SCHEMBL6816690 0.79 PDE2A (0.47) PDE2AHTR2AHTR2CHTR2BSCN10A

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
WO-2025215110-A1 NEW AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS SOS1 INHIBITORS LES LABORATOIRES SERVIER (FR) 2025-10-16 WO disclosed