SCHEMBL9766040

SCHEMBL9766040

O=C(O)Cc1cc(=O)[nH]c2cccc(F)c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47
FEN1 P39748 1/20 0.43
NOS2 P35228 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
DNMT1 P26358 1/20 0.42
RECQL P46063 1/20 0.42
CASP6 P55212 1/20 0.42

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
SCHEMBL9766064 0.83 NOS2 (0.43) FEN1NOS2MEN1KMT2AKDM4E
SCHEMBL4206904 0.77 ALDH1A1 (0.69) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8366302 0.75 ALDH1A1 (0.59) NOS2MEN1KMT2AKDM4EALDH1A1
SCHEMBL31376496 0.75 ALDH1A1 (0.59) NOS2MEN1KMT2AKDM4EALDH1A1
SCHEMBL1776571 0.72 TSHR (0.52) FEN1NOS2MEN1KMT2AKDM4E
SCHEMBL1771743 0.69 AR (0.48) FEN1
SCHEMBL9766071 0.69 KDM4E (0.39) KDM4EALDH1A1POLBGAAMAPT
SCHEMBL12652515 0.68 GRIN2D (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9452298 0.68 HPGD (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL723768 0.67 CXCL8 (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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-4983607-A ANTISEROTONINERGIC ACTIVITY SYNTHELABO (FR) 1991-01-08 US disclosed