SCHEMBL9834529

SCHEMBL9834529

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.50
HPGD P15428 1/20 0.50
ALDH1A1 P00352 3/20 0.49
NPC1 O15118 2/20 0.43
CASP3 P42574 1/20 0.43
MAPT P10636 7/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
RAB9A P51151 1/20 0.42
ATM Q13315 1/20 0.42
PDK1 Q15118 1/20 0.41
PDK2 Q15119 1/20 0.41
PDK3 Q15120 1/20 0.41
PDK4 Q16654 1/20 0.41
GAA P10253 3/20 0.41
ALOX12 P18054 1/20 0.41
POLB P06746 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
SCHEMBL9836882 0.90 EPHX1 (0.46) HPGDALDH1A1CASP3MAPTLMNA
SCHEMBL9835865 0.88 USP2 (0.48) USP2HPGDALDH1A1NPC1CASP3
SCHEMBL9867843 0.88 MEN1 (0.41) USP2HPGDALDH1A1CASP3MAPT
SCHEMBL9835593 0.88 NPSR1 (0.47) ALDH1A1MEN1KMT2A
SCHEMBL9835398 0.84 SMN1; SMN2 (0.49) HPGDALDH1A1NPC1CASP3LMNA
SCHEMBL9836972 0.83 MAPT (0.50) ALDH1A1NPC1MAPTLMNASMN1; SMN2
SCHEMBL9836182 0.83 ALDH1A1 (0.39) USP2HPGDALDH1A1NPC1MAPT
SCHEMBL9836424 0.81 MAPT (0.52) HPGDALDH1A1NPC1MAPTSMN1; SMN2
SCHEMBL9837587 0.81 LMNA (0.47) HPGDALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL9834634 0.81 CASP3 (0.47) USP2HPGDALDH1A1NPC1CASP3

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