SCHEMBL30157681

SCHEMBL30157681

O=C(CC1CCC(=O)N1Cc1cccc(F)c1F)NC1CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 8/20 0.53
▸ KMT2A Q03164 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ SIGMAR1 Q99720 6/20 0.42
▸ HPGD P15428 1/20 0.39
▸ CAPN1 P07384 1/20 0.39

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
SCHEMBL30157565 1.00 P2RX7 (0.53) P2RX7KMT2ASMN1; SMN2SIGMAR1HPGD
SCHEMBL30157290 1.00 P2RX7 (0.53) P2RX7KMT2ASMN1; SMN2SIGMAR1HPGD
SCHEMBL30157750 0.88 P2RX7 (0.57) P2RX7
SCHEMBL27246032 0.87 P2RX7 (0.53) P2RX7KMT2A
SCHEMBL30157509 0.86 P2RX7 (0.61) P2RX7
SCHEMBL29103291 0.85 P2RX7 (0.53) P2RX7KMT2A
SCHEMBL31551413 0.85 P2RX7 (0.53) P2RX7KMT2A
SCHEMBL30158703 0.85 P2RX7 (0.53) P2RX7KMT2A
SCHEMBL30157695 0.85 P2RX7 (0.52) P2RX7KMT2A
SCHEMBL30157485 0.85 P2RX7 (0.54) P2RX7

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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