SCHEMBL9258460

SCHEMBL9258460

Cl[C](Cl)CCCCCC1CCO1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.55
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
ALOX12 P18054 1/20 0.36
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.30
THRB P10828 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
USP2 O75604 1/20 0.30

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
SCHEMBL12677249 0.82 EPHX1 (0.76) EPHX1TP53HPGDALOX12ALDH1A1
SCHEMBL2352072 0.76 EPHX1 (0.61) EPHX1TP53HPGDALOX12ALDH1A1
SCHEMBL4915364 0.76 EPHX1 (0.61) EPHX1TP53HPGDALOX12ALDH1A1
SCHEMBL9847359 0.73 KDM5A (0.43) LMNAUSP2
SCHEMBL17393581 0.73
SCHEMBL25304106 0.71 EPHX1 (1.00) EPHX1ALDH1A1SMN1; SMN2THRB
SCHEMBL2731115 0.71 EPHX1 (1.00) EPHX1ALDH1A1SMN1; SMN2THRB
SCHEMBL11122975 0.71 EPHX1 (1.00) EPHX1ALDH1A1SMN1; SMN2THRB
SCHEMBL25262887 0.71 EPHX1 (1.00) EPHX1ALDH1A1SMN1; SMN2THRB
SCHEMBL250637 0.71 EPHX1 (0.61) EPHX1ALDH1A1SMN1; 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
US-5455355-A Postemergence, preemergence herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-10-03 US disclosed
US-5298632-A Herbicidal pyrimidine compounds, compositions containing the same and method of use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-03-29 US disclosed
US-5232897-A Herbicidal pyrimidine compounds, compositions containing the same and method of use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-03 US disclosed
EP-0457505-A2 Pyrimidine derivatives and their use as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-11-21 EP disclosed