SCHEMBL9730736

SCHEMBL9730736

C=CCNC(=O)NOc1cc(Cl)ccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.56
CYP1A2 P05177 2/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C19 P33261 1/20 0.56
POLB P06746 1/20 0.52
ALDH1A1 P00352 3/20 0.47
THRB P10828 1/20 0.47
LMNA P02545 3/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 1/20 0.40
GAA P10253 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL9673561 0.79 THRB (0.51) CYP1A2CYP3A4CYP2C19POLBALDH1A1
SCHEMBL9674668 0.72 HTT (0.44) HPGDALDH1A1LMNAHTTRAB9A
SCHEMBL10486979 0.71 ALDH1A1 (0.47) HPGDALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL9730826 0.69 MEN1 (0.42) HPGDALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL27981026 0.69 ALDH1A1 (0.77) HPGDPOLBALDH1A1THRBLMNA
SCHEMBL11448272 0.69 HPGD (1.00) HPGDCYP1A2CYP3A4CYP2C19POLB
SCHEMBL9731148 0.69 APEX1 (0.45) HPGDALDH1A1LMNAHTTRAB9A
SCHEMBL29076854 0.66 KMT2A (0.45) HPGDCYP1A2CYP3A4CYP2C19POLB
SCHEMBL9461873 0.66 PTGS2 (0.49) HPGDCYP1A2CYP3A4CYP2C19POLB
SCHEMBL11829735 0.66 CNR1 (0.51) ALDH1A1LMNAHTTRAB9ANPC1

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
US-5112385-A Useful in rice paddies KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1992-05-12 US disclosed
US-4968341-A PRE-AND POSTEMERGENCE HERBICIDES KUMIAI CHEMICAL INDUSTRY CO. (JP) 1990-11-06 US disclosed
EP-0183174-B1 SUBSTITUTED PHENOXY UREA, PROCESSES FOR ITS PREPARATION AND HERBICIDE CONTAINING IT AS ACTIVE INGREDIENT KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1988-10-26 EP disclosed
EP-0183174-A2 Substituted phenoxy urea, processes for its preparation and herbicide containing it as active ingredient KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1986-06-04 EP disclosed