SCHEMBL10948460

SCHEMBL10948460

O=C(c1ccccc1)N1C(=O)C(F)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
P2RX4 Q99571 2/20 0.47
BCHE P06276 4/20 0.46
ACHE P22303 4/20 0.46
CDK2 P24941 1/20 0.41
MEN1 O00255 2/20 0.39
POLB P06746 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALOX15 P16050 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK1 P28482 1/20 0.38
PTGDR2 Q9Y5Y4 3/20 0.38
PDE5A O76074 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
SCHEMBL8797180 0.76 KMT2A (0.47) KMT2AP2RX4BCHEACHEMEN1
SCHEMBL10732552 0.73 KMT2A (0.49) KMT2AP2RX4BCHEACHECDK2
SCHEMBL9666485 0.72 KMT2A (0.43) KMT2AP2RX4BCHEACHEMEN1
SCHEMBL15156770 0.70 AADAT (0.36) KMT2AMEN1POLBKDM4ELMNA
SCHEMBL29620057 0.68 AADAT (0.35) KMT2AMEN1POLBKDM4ELMNA
SCHEMBL8023047 0.66 P2RX4 (0.63) P2RX4BCHEACHE
SCHEMBL1321593 0.65 P2RX4 (0.57) KMT2AP2RX4BCHEACHENPC1
SCHEMBL16131284 0.65 P2RX4 (1.00) KMT2AP2RX4BCHEACHEMEN1
SCHEMBL18485408 0.65 ALDH1A1 (0.53) KMT2AP2RX4ACHEPOLBKDM4E
SCHEMBL21282131 0.65 P2RX4 (0.51) KMT2AP2RX4BCHEACHEHTT

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-4503073-A ANTIINFLAMMATORY, ANALGESIC, ANTICOAGULANT A. H. ROBINS COMPANY, INCORPORATED (US) 1985-03-05 US disclosed