SCHEMBL28451975

SCHEMBL28451975

CCSc1cc(C=CC(=O)O)cnc1-c1nc2cc(C(F)(F)F)cnc2n1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.51
▸ RAB9A P51151 1/20 0.34
▸ PPARD Q03181 4/20 0.34
▸ PPARA Q07869 4/20 0.34
▸ PPARG P37231 3/20 0.34
▸ FFAR1 O14842 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ AGBL2 Q5U5Z8 1/20 0.33
▸ EGLN1 Q9GZT9 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ PTPN11 Q06124 1/20 0.31
▸ APP P05067 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ ADRB2 P07550 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
SCHEMBL17986663 0.90 POLB (0.51) POLBHPGDALDH1A1L3MBTL1APP
SCHEMBL19664190 0.90 POLB (0.51) POLBHPGDALDH1A1L3MBTL1APP
SCHEMBL25765995 0.88 POLB (0.48) POLB
SCHEMBL18760427 0.86 POLB (0.49) POLBRAB9AALDH1A1MEN1KMT2A
SCHEMBL14677239 0.85 POLB (0.52) POLBRAB9AAGBL2EGLN1ALDH1A1
SCHEMBL29431598 0.85 POLB (0.52) POLBRAB9AAGBL2EGLN1ALDH1A1
SCHEMBL28453222 0.83 POLB (0.50) POLBPPARDPPARAPPARGAGBL2
SCHEMBL23971584 0.83 POLB (0.50) POLBRAB9AAGBL2EGLN1ALDH1A1
SCHEMBL15868302 0.81 POLB (0.48) POLBRAB9AALDH1A1MEN1KMT2A
SCHEMBL24067328 0.81 POLB (0.48) POLBRAB9AALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107207460-B Fused heterocyclic compound having cycloalkylpyridyl group or salt thereof, agricultural and horticultural insecticide containing the same, and method for using the same 日本农药株式会社 2020-09-15 — — CN disclosed
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