SCHEMBL30837166

SCHEMBL30837166

O=C1CCCc2cc(-c3ccc(OC(F)(F)F)cc3)ccc21

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 4/20 0.60
HRH3 Q9Y5N1 2/20 0.56
MAOB P27338 12/20 0.50
MAOA P21397 11/20 0.50
PRKCI P41743 1/20 0.46
ADAMTS4 O75173 1/20 0.46
DHODH Q02127 1/20 0.46

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
SCHEMBL1697983 0.88 MAOB (0.58) HSD17B1MAOBMAOAPRKCI
SCHEMBL29758928 0.88 MAOB (0.58) HSD17B1MAOBMAOAPRKCI
SCHEMBL30966007 0.86 MAOB (0.53) HSD17B1HRH3MAOBMAOAPRKCI
SCHEMBL17261615 0.85 MAOB (0.58) MAOBMAOAPRKCI
SCHEMBL4596879 0.81 HSD17B1 (0.65) HSD17B1HRH3MAOBMAOAPRKCI
SCHEMBL3010868 0.81 HSD17B1 (0.65) HSD17B1MAOBMAOAPRKCI
SCHEMBL26706343 0.79 MAOA (0.54) HRH3MAOBMAOAPRKCI
SCHEMBL6968452 0.79 HRH3 (0.57) HSD17B1HRH3MAOBDHODH
SCHEMBL7506302 0.79 HSD17B1 (0.71) HSD17B1HRH3MAOBMAOAPRKCI
SCHEMBL1239457 0.79 MAOB (0.60) HSD17B1HRH3MAOBMAOA

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-4573086-A1 METHANOGEN INHIBITORS Agrizeronz Limited Partnership (NZ) 2025-06-25 EP disclosed
CN-119998272-A Methanogen inhibitors 阿格里泽伦茨有限合伙公司 2025-05-13 CN disclosed
WO-2024039250-A1 METHANOGEN INHIBITORS PASTORAL GREENHOUSE GAS RESEARCH LIMITED (NZ) 2024-02-22 WO disclosed