SCHEMBL9843082

SCHEMBL9843082

O=C1NC(=O)N(c2ccccc2)C1c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
QPCT Q16769 6/20 0.57
LMNA P02545 3/20 0.44
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
RECQL P46063 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CA2 P00918 2/20 0.39
CCR1 P32246 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
SCHEMBL6566190 0.88 LMNA (0.48) QPCTLMNAALDH1A1GAASMN1; SMN2
SCHEMBL11415790 0.84 QPCT (0.54) QPCTALDH1A1KDM4EGAATDP1
SCHEMBL11281134 0.82 QPCT (0.52) QPCTLMNAALDH1A1SMN1; SMN2
SCHEMBL11405716 0.82 QPCT (0.52) QPCTALDH1A1KDM4EGAATDP1
SCHEMBL3583000 0.81 QPCT (0.49) QPCTLMNAALDH1A1
SCHEMBL3589146 0.81 QPCT (0.49) QPCTLMNAALDH1A1
SCHEMBL3582993 0.81 QPCT (0.49) QPCTLMNAALDH1A1
SCHEMBL11420791 0.80 QPCT (0.50) QPCTALDH1A1KDM4EGAATDP1
SCHEMBL11497150 0.78 QPCT (0.48) QPCTLMNAALDH1A1KDM4EGAA
SCHEMBL4565683 0.77 QPCT (0.48) QPCTLMNAMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0442448-A2 Heterocyclic carboxylic acids and esters Bristol-Myers Squibb Company (US) 1991-08-21 EP disclosed
US-4970225-A ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY (US) 1990-11-13 US disclosed
US-4281009-A SEDATIVES, ANALGESICS, ANTIULCER AGENTS, A HYPNOTIC AND ANTIHYPERTENSIVE AGENTS NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1981-07-28 US disclosed
EP-0006407-A1 Hydantoin derivatives, their preparation and pharmaceutical compositions containing them NIPPON ZOKI PHARMACEUTICAL CO. LTD. (JP) 1980-01-09 EP disclosed