SCHEMBL8092044

SCHEMBL8092044

CCN(C(=O)COc1nc2cc(Cl)ccc2o1)C(=CC(C)C)CC(C)C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
ALOX12 P18054 1/20 0.43
CASP3 P42574 2/20 0.41
ANO1 Q5XXA6 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PARP3 Q9Y6F1 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
FFAR2 O15552 1/20 0.35
CETP P11597 8/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
CEPT1 Q9Y6K0 1/20 0.34

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
SCHEMBL8092042 1.00 ALDH1A1 (0.43) ALDH1A1LMNAALOX12CASP3ANO1
SCHEMBL8101573 0.93 LMNA (0.35) ALDH1A1LMNAALOX12CASP3ANO1
SCHEMBL8101577 0.93 LMNA (0.35) ALDH1A1LMNAALOX12CASP3ANO1
SCHEMBL8101443 0.90 SMN1; SMN2 (0.42) ALDH1A1LMNAALOX12CASP3SENP7
SCHEMBL8101439 0.90 SMN1; SMN2 (0.42) ALDH1A1LMNAALOX12CASP3SENP7
SCHEMBL8099934 0.88 ALDH1A1 (0.44) ALDH1A1LMNAALOX12CASP3ANO1
SCHEMBL8099931 0.88 ALDH1A1 (0.44) ALDH1A1LMNAALOX12CASP3ANO1
SCHEMBL8108116 0.87 SMN1; SMN2 (0.38) ALDH1A1LMNAMEN1KMT2ATP53
SCHEMBL8108114 0.87 SMN1; SMN2 (0.38) ALDH1A1LMNAMEN1KMT2ATP53
SCHEMBL8105287 0.80 LMNA (0.36) ALDH1A1LMNAALOX12CASP3TP53

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
CN-1122665-C Herbicidal N-alkenyl heteroaryloxyacetamides AMERICAN CYANAMID CO (US) 2003-10-01 CN claimed
EP-1047679-A1 HERBICIDAL N-ALKENYL HETEROARYLYLOXYACETAMIDES AMERICAN CYANAMID COMPANY (US) 2000-11-02 EP claimed
WO-1999025702-A1 HERBICIDAL N-ALKENYL HETEROARYLYLOXYACETAMIDES AMERICAN CYANAMID COMPANY (US) 1999-05-27 WO claimed
CN-1122665-C Herbicidal N-alkenyl heteroaryloxyacetamides AMERICAN CYANAMID CO (US) 2003-10-01 CN disclosed
CN-1278807-A Herbicidal N-alkenyl Heteroaryloxyacetamides AMERICAN CYANAMID CO (US) 2001-01-03 CN disclosed
EP-1047679-A1 HERBICIDAL N-ALKENYL HETEROARYLYLOXYACETAMIDES AMERICAN CYANAMID COMPANY (US) 2000-11-02 EP disclosed
WO-1999025702-A1 HERBICIDAL N-ALKENYL HETEROARYLYLOXYACETAMIDES AMERICAN CYANAMID COMPANY (US) 1999-05-27 WO disclosed