SCHEMBL29159609

SCHEMBL29159609

O=C(O)COc1cc(F)c(Cl)c(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.46
MCL1 Q07820 1/20 0.43
FFAR1 O14842 1/20 0.42
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
ALOX15 P16050 2/20 0.42
LMNA P02545 1/20 0.41
THRB P10828 2/20 0.40
THRA P10827 1/20 0.40
PTPN7 P35236 1/20 0.39
HSD17B10 Q99714 2/20 0.39
HPGD P15428 1/20 0.39
PTPRB P23467 1/20 0.39
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KMT2A Q03164 1/20 0.38
LDHA P00338 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37

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
SCHEMBL22601791 0.88 MCL1 (0.49) PKMMCL1FFAR1PPARGPPARD
SCHEMBL29159665 0.80 PDK2 (0.41) LMNAHSD17B10HPGD
SCHEMBL31566186 0.80 PDK2 (0.41) LMNAHSD17B10HPGD
SCHEMBL19555342 0.77 ALOX15 (0.52) PKMMCL1FFAR1PPARGPPARD
SCHEMBL6835428 0.77 PTPN7 (0.53) PKMMCL1FFAR1PPARGPPARD
SCHEMBL3138757 0.75 ALOX15 (0.50) PKMMCL1FFAR1ALOX15LMNA
SCHEMBL26730009 0.74 HPGD (0.51) MCL1FFAR1ALOX15LMNATHRB
SCHEMBL7491758 0.73 MCL1 (0.66) MCL1FFAR1PPARGPPARDALOX15
SCHEMBL22601788 0.73 MCL1 (0.56) MCL1ALOX15LMNATHRBTHRA
SCHEMBL22588114 0.72 LDHA (0.47) MCL1FFAR1PPARGPPARDALOX15

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-117580824-A Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2024-02-20 CN disclosed