SCHEMBL31258279

SCHEMBL31258279

Cc1ccccc1P(Cl)c1ccccc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.47
ACHE P22303 3/20 0.47
ALDH1A1 P00352 4/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CYP3A4 P08684 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.35
FTO Q9C0B1 1/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2A6 P11509 2/20 0.35
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
ESR1 P03372 1/20 0.32
LMNA P02545 1/20 0.32
ALOX12 P18054 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL541710 1.00 TSHR (0.47) TSHRACHEALDH1A1CA1CA2
SCHEMBL2154271 0.85 ACHE (0.39) TSHRACHEALDH1A1CA1CA2
SCHEMBL258502 0.83 TSHR (0.47) TSHRACHEALDH1A1CA1CA2
SCHEMBL12311876 0.83 CA1 (0.44) TSHRACHEALDH1A1CA1CA2
Hydrochloric Acid SCHEMBL15845273 0.81 TSHR (0.45) TSHRACHEALDH1A1CA1CA2
SCHEMBL9326405 0.79 TSHR (0.43) TSHRACHEALDH1A1CA1CA2
SCHEMBL11079984 0.79 TRPA1 (0.42) TSHRACHEALDH1A1CA1CA2
SCHEMBL1176479 0.79 TSHR (0.43) TSHRACHEALDH1A1CA1CA2
SCHEMBL8647690 0.78 TSHR (0.47) TSHRACHEALDH1A1CA1CA2
SCHEMBL4480 0.77 TSHR (0.53) TSHRACHEALDH1A1CA1CA2

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
CN-119998255-A Catalytic carboxycarbonylation of olefins to form anhydrides 北卡罗来纳大学教堂山分校 2025-05-13 CN disclosed
US-12157113-B2 Sonication method for making magnetic supported catalysts KING FAHD UNIVERSITY OF PETOLEUM AND MINERALS (SA) 2024-12-03 US disclosed