SCHEMBL9836716

SCHEMBL9836716

C=C(C)C(OC(=O)Nc1cc(OCC)c(Cl)cc1Cl)C(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.41
RECQL P46063 2/20 0.40
KDM4E B2RXH2 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
HPGD P15428 1/20 0.40
NPC1 O15118 2/20 0.39
MITF O75030 2/20 0.39
RAB9A P51151 2/20 0.39
MAPK1 P28482 2/20 0.39
THRB P10828 1/20 0.39
ALDH1A1 P00352 5/20 0.38
LMNA P02545 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GAA P10253 3/20 0.37
KDR P35968 1/20 0.37
MAPT P10636 3/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 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
SCHEMBL9835963 0.90 RORC (0.39) RORCRECQLKDM4ESMN1; SMN2HPGD
SCHEMBL27309659 0.90 RORC (0.41) RORCRECQLKDM4ESMN1; SMN2HPGD
SCHEMBL9836051 0.83 RORC (0.48) RORCSMN1; SMN2HPGDNPC1RAB9A
SCHEMBL9837587 0.81 LMNA (0.47) KDM4ESMN1; SMN2HPGDALDH1A1LMNA
SCHEMBL9836050 0.81 L3MBTL1 (0.41) RECQLKDM4ETHRBALDH1A1LMNA
SCHEMBL8998061 0.81 ALDH1A1 (0.35) RORCRECQLSMN1; SMN2HPGDNPC1
SCHEMBL9836744 0.79 GAA (0.44) RORCKDM4ESMN1; SMN2HPGDMAPK1
SCHEMBL9837428 0.78 LMNA (0.37) RORCRECQLKDM4ESMN1; SMN2HPGD
SCHEMBL9620075 0.76 SCN9A (0.41) RORCRECQLGAA
SCHEMBL25658780 0.76 ALDH1A1 (0.61) RORCRECQLKDM4ESMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed