SCHEMBL30949546

SCHEMBL30949546

O=C(O)c1ccc2c(c1Cl)CCO2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
FABP4 P15090 7/20 0.39
FABP3 P05413 3/20 0.39
FABP5 Q01469 2/20 0.39
PRKAB2 O43741 1/20 0.38
PRKAG1 P54619 1/20 0.38
PRKAA2 P54646 1/20 0.38
PRKAA1 Q13131 1/20 0.38
PRKAG3 Q9UGI9 1/20 0.38
PRKAG2 Q9UGJ0 1/20 0.38
PRKAB1 Q9Y478 1/20 0.38
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
TP53 P04637 1/20 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
SCHEMBL30949548 0.81 KDM4E (0.44) TSHRALDH1A1KDM4ESMN1; SMN2NPC1
SCHEMBL9188696 0.81 SMN1; SMN2 (0.38) FABP4FABP3FABP5ALDH1A1KDM4E
SCHEMBL29091574 0.79 G6PD (0.38) TSHRFABP4ALDH1A1KDM4EHPGD
SCHEMBL30615163 0.79 G6PD (0.38) TSHRFABP4ALDH1A1KDM4EHPGD
SCHEMBL668562 0.77 GRIK1 (0.39) TSHRFABP4FABP3FABP5ALDH1A1
SCHEMBL31417805 0.77 KDM4E (0.36) ALDH1A1KDM4EHPGDHSD17B10HTT
SCHEMBL29421547 0.76 DPP4 (0.44) FABP4FABP3FABP5PRKAB2PRKAG1
SCHEMBL21225332 0.76 DPP4 (0.44) FABP4FABP3FABP5PRKAB2PRKAG1
SCHEMBL496918 0.75 SLC9A1 (0.43) FABP4FABP3FABP5ALDH1A1KDM4E
SCHEMBL3716928 0.74 ALOX5 (0.39) TSHRFABP4NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4652154-A1 NOVEL ALPK1 INHIBITORS Pyrotech (Beijing) Biotechnology Co., Ltd. (CN) 2025-11-26 EP disclosed
WO-2024153225-A1 NOVEL ALPK1 INHIBITORS PYROTECH (BEIJING) BIOTECHNOLOGY CO., LTD. (CN) 2024-07-25 WO disclosed