SCHEMBL11717344

SCHEMBL11717344

O=C(Nc1ccccc1C(Cl)(Cl)Cl)N1CCCC1CO

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ DHODH Q02127 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ ITGB3 P05106 1/20 0.44
▸ ITGB1 P05556 1/20 0.44
▸ ITGAV P06756 1/20 0.44
▸ ITGA5 P08648 1/20 0.44
▸ ITGA4 P13612 1/20 0.44
▸ POLB P06746 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ HRH3 Q9Y5N1 3/20 0.43
▸ MAPT P10636 1/20 0.42
▸ CHRM2 P08172 2/20 0.40
▸ CHRM4 P08173 2/20 0.40
▸ CHRM1 P11229 2/20 0.40
▸ CHRM3 P20309 2/20 0.40
▸ ATM Q13315 1/20 0.40

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
SCHEMBL11720348 0.81 ALDH1A1 (0.51) EPHX2KMT2AMEN1DHODHTDP1
SCHEMBL11719448 0.78 KMT2A (0.70) EPHX2KMT2AMEN1POLBL3MBTL1
SCHEMBL5001911 0.74 POLB (0.64) POLBHRH3
SCHEMBL5001913 0.74 POLB (0.64) POLBHRH3
SCHEMBL15652855 0.73 ITGB3 (0.47) EPHX2KMT2AMEN1DHODHTDP1
SCHEMBL15652856 0.73 ITGB3 (0.47) EPHX2KMT2AMEN1DHODHTDP1
SCHEMBL11718519 0.72 L3MBTL1 (0.58) EPHX2KMT2AMEN1DHODHL3MBTL1
SCHEMBL11720518 0.70 EPHX2 (0.61) EPHX2KMT2AMEN1TDP1POLB
SCHEMBL11717787 0.70 LMNA (0.51) EPHX2KMT2AMEN1TDP1ITGB3
SCHEMBL15653394 0.70 MAPT (0.49) EPHX2KMT2AMEN1DHODHTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4065291-A Herbicidal 1-(2-hydroxymethylpyrrolidinyl) carboxanilides CHEVRON RESEARCH COMPANY (US) 1977-12-27 — — US disclosed
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