SCHEMBL31370971

SCHEMBL31370971

CC(Sc1cc(Br)ccc1Cl)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.48
HTT P42858 1/20 0.48
PTPRC P08575 1/20 0.42
PTPRG P23470 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MEN1 O00255 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPK1 P28482 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HPGD P15428 2/20 0.38
SLC22A12 Q96S37 2/20 0.36
TYMP P19971 2/20 0.36

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
SCHEMBL9849304 0.76 RXFP1 (0.49) PPARAALDH1A1KDM4ELMNANPSR1
SCHEMBL20448402 0.75 HPGD (0.43) HTTPTPRCPTPRGALDH1A1MEN1
SCHEMBL9780541 0.73 PPARA (0.50) PPARAALDH1A1MEN1TSHRKMT2A
SCHEMBL9780537 0.73 PPARA (0.50) PPARAALDH1A1MEN1TSHRKMT2A
SCHEMBL7048451 0.72 MEN1 (0.51) PPARAHTTALDH1A1MEN1TSHR
SCHEMBL11341164 0.71 LMNA (0.46) PPARAHTTMEN1TSHRKMT2A
SCHEMBL18970756 0.71 SLC22A12 (0.61) PPARAHTTALDH1A1TSHRNPSR1
SCHEMBL20448299 0.70 PTPRC (0.50) PTPRCPTPRGALDH1A1MEN1KMT2A
SCHEMBL28798831 0.70 MAOA (0.50) PPARAHTTALDH1A1KDM4ELMNA
SCHEMBL29829123 0.70 MAOA (0.50) PPARAHTTALDH1A1KDM4ELMNA

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-119384413-A Anilino-pyrazole derivatives, compositions and methods thereof 昂胜医药有限公司 2025-01-28 CN disclosed