SCHEMBL24815907

SCHEMBL24815907

O=c1[nH]c(=O)c2c(F)ccc(Cl)c2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.47
CLCN2 P51788 1/20 0.47
IDO1 P14902 5/20 0.41
TYMP P19971 3/20 0.39
CASP6 P55212 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.36
HTT P42858 2/20 0.35
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
CYP19A1 P11511 1/20 0.35
TSHR P16473 1/20 0.35
THPO P40225 1/20 0.35
MTOR P42345 1/20 0.35
HBB P68871 1/20 0.35
PMP22 Q01453 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PTK2B Q14289 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL7026646 0.84 CASP6 (0.41) IDO1TYMPCASP6HTTLMNA
SCHEMBL7027217 0.84 HTT (0.42) ADRA2ACLCN2IDO1TYMPHTT
SCHEMBL7034110 0.78 IDH1 (0.35) ADRA2ACLCN2IDO1TYMPHTT
SCHEMBL3424330 0.75 ADRA2A (0.44) ADRA2ACLCN2ERCC1ERCC4DAO
SCHEMBL25329522 0.75 NQO2 (0.46) CASP6HTTLMNAALDH1A1MAPT
SCHEMBL7031565 0.70 CAPN1 (0.40) IDO1TYMPHTTPTK2BGDA
SCHEMBL24815911 0.70 DAO (0.46) IDO1TYMPHTTLMNAALDH1A1
SCHEMBL22866846 0.70 IDH1 (0.35) IDO1TYMPHTTLMNAALDH1A1
SCHEMBL29561245 0.70 IDH1 (0.35) IDO1TYMPHTTLMNAALDH1A1
SCHEMBL7028889 0.69 ALDH1A1 (0.38) IDO1TYMPHTTLMNAALDH1A1

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-2022271684-A1 DIACYLGLYERCOL KINASE MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2022-12-29 WO disclosed