SCHEMBL30158747

SCHEMBL30158747

O=C(O)CC1CCC(=O)N1Cc1cc(F)cc(C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 3/20 0.43
▸ PTGER4 P35408 4/20 0.41
▸ PTGER3 P43115 4/20 0.41
▸ PTGER2 P43116 2/20 0.41
▸ P2RX7 Q99572 2/20 0.39
▸ RXRA P19793 1/20 0.38
▸ RXRB P28702 1/20 0.38
▸ RXRG P48443 1/20 0.38
▸ PDE2A O00408 3/20 0.38
▸ CETP P11597 1/20 0.38
▸ RORC P51449 1/20 0.37
▸ CMA1 P23946 1/20 0.37
▸ FFAR1 O14842 1/20 0.36

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
SCHEMBL30158802 0.89 P2RX7 (0.39) P2RX7
SCHEMBL30158686 0.80 MDM2 (0.38) FFAR4P2RX7
SCHEMBL31705306 0.80 KMT2A (0.48) P2RX7
SCHEMBL30158586 0.79 HCRTR2 (0.49) P2RX7
SCHEMBL30158612 0.78 P2RX7 (0.44) PTGER4PTGER3PTGER2P2RX7PDE2A
SCHEMBL30158699 0.76 ALDH1A1 (0.50) PTGER3P2RX7
SCHEMBL30158611 0.76 ALDH1A1 (0.50) PTGER3P2RX7
SCHEMBL24809891 0.75 RIPK1 (0.40) FFAR4P2RX7FFAR1
SCHEMBL31551184 0.75 RIPK1 (0.40) FFAR4P2RX7FFAR1
SCHEMBL31706028 0.74 ITGB1 (0.47) 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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