SCHEMBL29586549

SCHEMBL29586549

COc1cc(-c2cc(C(=O)O)n[nH]2)c(Cl)cn1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 10/20 0.41
▸ PRKAG1 P54619 1/20 0.40
▸ PRKAA1 Q13131 1/20 0.40
▸ PRKAB1 Q9Y478 1/20 0.40
▸ DAO P14920 1/20 0.40
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ SIRT6 Q8N6T7 1/20 0.37
▸ HCAR3 P49019 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ NNMT P40261 1/20 0.35
▸ ALOX15 P16050 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
SCHEMBL24424513 1.00 HCAR2 (0.41) HCAR2PRKAG1PRKAA1PRKAB1DAO
SCHEMBL24423705 0.84 HCAR2 (0.42) HCAR2DAOMEN1KMT2APOLB
SCHEMBL30630483 0.84 HCAR2 (0.42) HCAR2DAOMEN1KMT2APOLB
SCHEMBL24424425 0.81 NPC1 (0.42) MEN1KMT2APOLB
SCHEMBL24423866 0.80 GAA (0.40) KMT2AMAPT
SCHEMBL29585305 0.79 MGLL (0.33) —
SCHEMBL24423448 0.79 MGLL (0.33) —
SCHEMBL24423714 0.79 MGLL (0.33) —
SCHEMBL24424639 0.79 ACACB (0.37) —
SCHEMBL24423040 0.79 FFAR2 (0.35) PRKAG1PRKAA1PRKAB1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 — — EP disclosed
CN-116635380-A PPARgamma modulators and methods of use 卫材R&D管理有限公司 2023-08-22 — — CN disclosed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 — — WO disclosed
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