SCHEMBL10693019

SCHEMBL10693019

COC(=O)C1CCC(=O)N1Cc1ccccc1C(F)(F)F

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 17/20 0.64
▸ CAPN1 P07384 1/20 0.55
▸ KDM4E B2RXH2 2/20 0.50
▸ ALDH1A1 P00352 1/20 0.50

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
SCHEMBL289278 0.88 KDM4E (0.65) P2RX7CAPN1KDM4EALDH1A1
SCHEMBL1612567 0.88 KDM4E (0.65) P2RX7CAPN1KDM4EALDH1A1
SCHEMBL288664 0.86 P2RX7 (0.61) P2RX7CAPN1KDM4EALDH1A1
SCHEMBL289740 0.86 P2RX7 (0.61) P2RX7CAPN1KDM4EALDH1A1
SCHEMBL24434796 0.78 KMT2A (0.57) P2RX7CAPN1ALDH1A1
SCHEMBL927807 0.78 KMT2A (0.57) P2RX7CAPN1ALDH1A1
SCHEMBL2583749 0.78 KMT2A (0.57) P2RX7CAPN1ALDH1A1
SCHEMBL2581865 0.78 P2RX7 (1.00) P2RX7
SCHEMBL2581860 0.78 P2RX7 (1.00) P2RX7
SCHEMBL30158884 0.77 P2RX7 (0.54) P2RX7CAPN1KDM4EALDH1A1

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
US-4742061-A Benzoc[c]-1,5-naphthyridines and related compounds as memory enhancing agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1988-05-03 — — US disclosed
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