SCHEMBL10951983

SCHEMBL10951983

CC1=C(C)C(=O)N(CCl)C1=O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
PKM P14618 1/20 0.44
BLM P54132 1/20 0.32
WRN Q14191 1/20 0.32
POLB P06746 1/20 0.31
F2 P00734 1/20 0.30
ELANE P08246 1/20 0.30
CTSG P08311 1/20 0.30
CTRC Q99895 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
SCHEMBL15384492 0.75 ALDH1A1 (0.48) ALDH1A1PKMPOLBF2ELANE
SCHEMBL10901592 0.75 ALDH1A1 (0.61) ALDH1A1PKMF2ELANECTSG
SCHEMBL14011308 0.73 F2 (0.53) ALDH1A1PKMBLMPOLBF2
SCHEMBL15977327 0.72 ALDH1A1 (0.41) ALDH1A1PKMPOLB
SCHEMBL22403737 0.71 ALDH1A1 (0.44) ALDH1A1PKMF2ELANECTSG
SCHEMBL7468866 0.69 ALDH1A1 (0.48) ALDH1A1PKMPOLB
SCHEMBL10785350 0.69 ALDH1A1 (0.43) ALDH1A1PKMPOLB
SCHEMBL9563132 0.69 ALDH1A1 (0.54) ALDH1A1PKMF2ELANECTSG
SCHEMBL10703043 0.69 ALDH1A1 (0.54) ALDH1A1PKM
SCHEMBL7464004 0.67 ALDH1A1 (0.38) ALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4531008-A Insecticide, miticide SUMITOMO CHEMICAL CO., LTD. (JP) 1985-07-23 US disclosed
US-4266074-A SUBSTITUTED PHENYL BUTENYL ACETATES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1981-05-05 US disclosed
US-4062968-A MITICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-12-13 US disclosed
US-4058622-A Substituted phenyl acetate, insecticidal composition and method of use SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-11-15 US disclosed
US-4039680-A SULFUR CONTAINING HETEROCYCLES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-08-02 US disclosed
US-4031235-A Insecticidal substituted acetate compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-06-21 US disclosed
US-3996244-A Insecticidal esters of substituted furan methanol SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-12-07 US disclosed