SCHEMBL30157332

SCHEMBL30157332

CC(C)CCNC(=O)CC1CCC(=O)N1Cc1cccc(F)c1F

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 14/20 0.53
▸ POLB P06746 1/20 0.39
▸ GPR119 Q8TDV5 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ CHRM4 P08173 1/20 0.38

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
SCHEMBL30157744 0.90 P2RX7 (0.55) P2RX7POLBGPR119ALDH1A1
SCHEMBL30158742 0.89 P2RX7 (0.59) P2RX7ALDH1A1
SCHEMBL30158053 0.88 P2RX7 (0.54) P2RX7ALDH1A1
SCHEMBL30157509 0.87 P2RX7 (0.61) P2RX7ALDH1A1
SCHEMBL30158093 0.86 P2RX7 (0.53) P2RX7ALDH1A1
SCHEMBL30157499 0.86 P2RX7 (0.53) P2RX7ALDH1A1
SCHEMBL30157993 0.86 P2RX7 (0.55) P2RX7ALDH1A1
SCHEMBL30157597 0.85 P2RX7 (0.52) P2RX7ALDH1A1
SCHEMBL30158610 0.85 P2RX7 (0.53) P2RX7POLBGPR119ALDH1A1
SCHEMBL30157750 0.84 P2RX7 (0.57) P2RX7ALDH1A1

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
WO-2022268520-A1 USE OF SUBSTITUTED PYRROLIDINONES OR THEIR SALTS FOR INCREASING STRESS TOLERANCE OF PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2022-12-29 — — WO disclosed
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