SCHEMBL9730830

SCHEMBL9730830

COC(COc1cc(Cl)ccc1Cl)NC(N)=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
MRGPRX4 Q96LA9 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
NLRP1 Q9C000 1/20 0.39
THRB P10828 1/20 0.38

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
SCHEMBL875817 0.70 MEN1 (0.52) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL11594971 0.68 KMT2A (0.57) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL14959979 0.68 ALDH1A1 (0.51) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL12656154 0.68 TSHR (0.50) ALDH1A1KDM4ELMNASMN1; SMN2CYP1A2
SCHEMBL9730826 0.68 MEN1 (0.42) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL11593849 0.66 KMT2A (0.58) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL10486979 0.66 ALDH1A1 (0.47) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2
SCHEMBL15393164 0.66 MEN1 (0.58) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL2126324 0.66 SMN1; SMN2 (0.47) ALDH1A1LMNASMN1; SMN2HPGD
SCHEMBL3737643 0.66 GAA (0.56) MEN1KMT2AALDH1A1KDM4ELMNA

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