SCHEMBL9836048

SCHEMBL9836048

C/C=C(\CC)C(OC(=O)Nc1ccccc1)C(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 2/20 0.44
CASP7 P55210 1/20 0.42
CASP9 P55211 1/20 0.42
CASP6 P55212 1/20 0.42
CASP8 Q14790 1/20 0.42
LMNA P02545 4/20 0.42
TP53 P04637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RAB9A P51151 4/20 0.42
NPC1 O15118 3/20 0.42
HPGD P15428 2/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL9836055 1.00 CASP3 (0.44) CASP3CASP7CASP9CASP6CASP8
SCHEMBL9834808 0.87 MAPT (0.54) LMNARAB9ANPC1HPGDALDH1A1
SCHEMBL9833996 0.77 SMN1; SMN2 (0.45) LMNATP53NPSR1RAB9ANPC1
SCHEMBL24654500 0.76 KLK7 (0.53) CASP3LMNATP53NPSR1RAB9A
SCHEMBL24654619 0.76 KLK7 (0.56) LMNATP53NPSR1RAB9ANPC1
SCHEMBL9834634 0.75 CASP3 (0.47) CASP3LMNARAB9ANPC1HPGD
SCHEMBL10639437 0.73 RAB9A (0.50) CASP3CASP7CASP9CASP6CASP8
Propham SCHEMBL8536412 0.72 SMN1; SMN2 (0.66) CASP3LMNATP53RAB9ANPC1
Propham SCHEMBL67344 0.72 SMN1; SMN2 (0.66) CASP3LMNATP53RAB9ANPC1
SCHEMBL9837790 0.71 RAB9A (0.49) LMNANPSR1RAB9ANPC1HPGD

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-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
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed