SCHEMBL29612481

SCHEMBL29612481

Cc1ccc2cc(Oc3c(Cl)cc(N)cc3Cl)ccc2n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
POLB P06746 2/20 0.53
LMNA P02545 1/20 0.53
CASP6 P55212 1/20 0.53
CYP1A2 P05177 3/20 0.44
NCF1 P14598 5/20 0.42
CYP3A4 P08684 1/20 0.35
PPARG P37231 1/20 0.35
NCK1 P16333 1/20 0.35
BACE1 P56817 1/20 0.35
ENPP3 O14638 1/20 0.35
ALPL P05186 1/20 0.35
ENPP1 P22413 1/20 0.35
XIAP P98170 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TEC P42680 1/20 0.35
NQO1 P15559 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
SCHEMBL23062670 1.00 KDM4E (0.53) KDM4EPOLBLMNACASP6CYP1A2
SCHEMBL23042415 0.80 HTT (0.43) KDM4EPOLBLMNACASP6CYP1A2
SCHEMBL29612747 0.79 NCF1 (0.35) NCF1CYP3A4PPARGBACE1TEC
SCHEMBL23062649 0.79 NCF1 (0.35) NCF1CYP3A4PPARGBACE1TEC
SCHEMBL3141130 0.78 THRB (0.57)
SCHEMBL23061561 0.78 PPARG (0.41) KDM4EPOLBCYP1A2CYP3A4PPARG
SCHEMBL29612505 0.78 PPARG (0.41) KDM4EPOLBCYP1A2CYP3A4PPARG
SCHEMBL23063015 0.77 PPARG (0.56) KDM4EPOLBCASP6CYP3A4PPARG
SCHEMBL29612552 0.77 PPARG (0.56) KDM4EPOLBCASP6CYP3A4PPARG
SCHEMBL11292862 0.77 HTT (0.53) KDM4ELMNACYP1A2CYP3A4PPARG

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-4017875-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS Terns Pharmaceuticals, Inc. (US) 2022-06-29 EP disclosed
CN-114430743-A Thyroid hormone receptor beta agonist compounds 拓臻制药公司 2022-05-03 CN disclosed