SCHEMBL28453222

SCHEMBL28453222

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

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.50
▸ AGBL2 Q5U5Z8 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TRPV1 Q8NER1 1/20 0.34
▸ PPARG P37231 7/20 0.33
▸ PPARD Q03181 7/20 0.33
▸ PPARA Q07869 7/20 0.33
▸ EGLN1 Q9GZT9 2/20 0.33
▸ CHRNA7 P36544 1/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31
▸ RXRG P48443 1/20 0.31
▸ AKR1B1 P15121 2/20 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
SCHEMBL17986796 0.90 POLB (0.52) POLBAGBL2TRPV1EGLN1CHRNA7
SCHEMBL24067328 0.88 POLB (0.48) POLBMEN1KMT2A
SCHEMBL29431598 0.87 POLB (0.52) POLBAGBL2SMN1; SMN2EGLN1MEN1
SCHEMBL14677239 0.87 POLB (0.52) POLBAGBL2SMN1; SMN2EGLN1MEN1
SCHEMBL23971584 0.84 POLB (0.50) POLBAGBL2EGLN1MEN1KMT2A
SCHEMBL28451975 0.83 POLB (0.51) POLBAGBL2PPARGPPARDPPARA
SCHEMBL15868302 0.83 POLB (0.48) POLBMEN1KMT2A
SCHEMBL14676535 0.82 POLB (0.48) POLBMEN1KMT2A
SCHEMBL23729027 0.82 POLB (0.48) POLBSMN1; SMN2MEN1KMT2A
SCHEMBL14684609 0.82 POLB (0.48) POLBMEN1KMT2A

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
Send feedback