SCHEMBL9834634

SCHEMBL9834634

CC=C(CC)C(OC(=O)Nc1ccc(Cl)cc1Cl)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.47
MAPT P10636 5/20 0.46
ALDH1A1 P00352 2/20 0.46
USP2 O75604 1/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.44
GAA P10253 2/20 0.44
POLB P06746 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
LMNA P02545 3/20 0.44
HTT P42858 1/20 0.44
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
RAB9A P51151 1/20 0.40

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
SCHEMBL9834808 0.83 MAPT (0.54) MAPTALDH1A1HPGDNPC1SMN1; SMN2
SCHEMBL9834529 0.81 USP2 (0.50) CASP3MAPTALDH1A1USP2HPGD
SCHEMBL11794832 0.77 HPGD (0.59) CASP3MAPTALDH1A1USP2HPGD
SCHEMBL9836020 0.76 ALDH1A1 (0.49) CASP3MAPTALDH1A1USP2HPGD
SCHEMBL9836048 0.75 CASP3 (0.44) CASP3MAPTALDH1A1HPGDNPC1
SCHEMBL9836055 0.75 CASP3 (0.44) CASP3MAPTALDH1A1HPGDNPC1
SCHEMBL6333143 0.74 MAPT (0.63) MAPTALDH1A1USP2HPGDNPC1
SCHEMBL2095473 0.73 HPGD (0.58) MAPTALDH1A1USP2HPGDNPC1
SCHEMBL9835865 0.72 USP2 (0.48) CASP3MAPTALDH1A1USP2HPGD
SCHEMBL9836882 0.71 EPHX1 (0.46) CASP3MAPTALDH1A1HPGDSMN1; SMN2

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