SCHEMBL31404142

SCHEMBL31404142

CC(=O)n1c(C(F)F)cc2cc(F)ccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR2A P28223 2/20 0.37
HTR2C P28335 2/20 0.37
CCR2 P41597 1/20 0.36
NOTUM Q6P988 1/20 0.35
ACLY P53396 2/20 0.34
SIGMAR1 Q99720 1/20 0.34
PDPK1 O15530 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
APEX1 P27695 1/20 0.34
CYP2C19 P33261 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
IDO1 P14902 1/20 0.34

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
SCHEMBL17022501 0.79 KDM4E (0.49) HSD17B10KDM4EALDH1A1HPGDMEN1
SCHEMBL4054875 0.72 KDM4E (0.53) HSD17B10KDM4EALDH1A1HPGDMEN1
SCHEMBL17674054 0.69 KDM4E (0.49) HSD17B10KDM4EALDH1A1HPGDMEN1
SCHEMBL14134350 0.69 NR1H2 (0.47) HSD17B10KDM4EALDH1A1HPGDMEN1
SCHEMBL27178977 0.69 PTGDR2 (0.50) ACLYLMNA
SCHEMBL3560996 0.68 POLB (0.42) HSD17B10KDM4EALDH1A1MEN1KMT2A
SCHEMBL3556800 0.67 AKR1C3 (0.42)
SCHEMBL986506 0.66 KDM4E (1.00) HSD17B10KDM4EALDH1A1HPGDMEN1
SCHEMBL20559207 0.66 KDM4E (0.53) HSD17B10KDM4EALDH1A1HPGDMEN1
SCHEMBL2732524 0.66 KDM4E (0.76) HSD17B10KDM4EALDH1A1HPGDMEN1

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
CN-119546574-A Antiviral indolinyl compounds and uses thereof 吉利德科学公司 2025-02-28 CN disclosed