SCHEMBL5179929

SCHEMBL5179929

CCC(Cl)(Cl)OP(=O)(O)Oc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
SRC P12931 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.44
POLB P06746 1/20 0.41
ANPEP P15144 2/20 0.41
LAP3 P28838 2/20 0.41
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
BTN3A1 O00481 1/20 0.37

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
SCHEMBL11710693 0.88 ALDH1A1 (0.46) ALDH1A1SRCL3MBTL1POLBANPEP
SCHEMBL11787671 0.81 SRC (0.52) ALDH1A1SRCL3MBTL1POLBANPEP
SCHEMBL28960008 0.81 SRC (0.55) ALDH1A1SRCL3MBTL1POLBANPEP
SCHEMBL525387 0.78 SRC (0.55) ALDH1A1SRCL3MBTL1POLBANPEP
Butane SCHEMBL924011 0.77 SRC (0.59) ALDH1A1SRCL3MBTL1POLBANPEP
SCHEMBL9860272 0.76 FDPS (0.34) TDP1
SCHEMBL11714349 0.76 SRC (0.53) ALDH1A1SRCL3MBTL1POLBANPEP
SCHEMBL28898519 0.75 SRC (0.57) ALDH1A1SRCL3MBTL1POLBANPEP
SCHEMBL28363135 0.75 SRC (0.57) ALDH1A1SRCL3MBTL1POLBANPEP
SCHEMBL11121914 0.75 ALDH1A1 (0.52) ALDH1A1SRCL3MBTL1POLBANPEP

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0627420-B1 PROCESS FOR THE SYNTHESIS OF MALEIMIDE COMPOUND IMPROVED IN STORAGE STABILITY NIPPON CATALYTIC CHEM IND (JP) 2007-03-14 EP disclosed
EP-0437342-B1 Method for handling maleimides NIPPON CATALYTIC CHEM IND (JP) 1997-03-26 EP disclosed
US-5556991-A SUPPRESSION OF BY-PRODUCTS IN REACTION OF MALEIC ANHYDRIDE WITH PRIMARY AMINE NIPPON SHOKUBAI CO., LTD. (JP) 1996-09-17 US disclosed
EP-0627420-A1 MALEIMIDE COMPOUND IMPROVED IN STORAGE STABILITY NIPPON SHOKUBAI CO., LTD. (JP) 1994-12-07 EP disclosed
US-5149827-A In presence of stabilizer at temperature higher than the melting point of maleimide NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) 1992-09-22 US disclosed
EP-0437342-A2 Method for handling maleimides NIPPON SHOKUBAI CO., LTD. (JP) 1991-07-17 EP disclosed