SCHEMBL10500265

SCHEMBL10500265

CCN(C#N)C(=O)C(C)Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 3/20 0.61
▸ ALDH1A1 P00352 3/20 0.61
▸ MAPT P10636 3/20 0.61
▸ LMNA P02545 3/20 0.61
▸ CYP3A4 P08684 2/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ HPGD P15428 2/20 0.61
▸ NPSR1 Q6W5P4 2/20 0.61
▸ TP53 P04637 1/20 0.61
▸ ALOX15 P16050 1/20 0.61
▸ NFKB1 P19838 1/20 0.61
▸ HIF1A Q16665 1/20 0.61
▸ GMNN O75496 1/20 0.61
▸ APEX1 P27695 1/20 0.61
▸ PMP22 Q01453 1/20 0.61
▸ HTT P42858 5/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ CYP2C19 P33261 2/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ GLA P06280 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
SCHEMBL10499524 0.89 ALDH1A1 (0.46) CYP1A2ALDH1A1MAPTLMNACYP3A4
SCHEMBL10500120 0.89 CYP1A2 (0.63) CYP1A2ALDH1A1MAPTLMNACYP3A4
Quizalofop Ethyl Ester SCHEMBL9139248 0.82 MAPT (0.67) CYP1A2ALDH1A1MAPTLMNACYP3A4
Quizalofop Ethyl Ester SCHEMBL30406 0.82 MAPT (0.67) CYP1A2ALDH1A1MAPTLMNACYP3A4
Quizalofop-P-Ethyl SCHEMBL29474422 0.82 MAPT (0.67) CYP1A2ALDH1A1MAPTLMNACYP3A4
Quizalofop-P-Ethyl SCHEMBL53466 0.82 MAPT (0.67) CYP1A2ALDH1A1MAPTLMNACYP3A4
SCHEMBL7083043 0.82 ALDH1A1 (0.72) CYP1A2ALDH1A1MAPTLMNACYP3A4
Quizalofop SCHEMBL1010164 0.82 ALDH1A1 (0.72) CYP1A2ALDH1A1MAPTLMNACYP3A4
Quizalofop SCHEMBL63325 0.82 ALDH1A1 (0.72) CYP1A2ALDH1A1MAPTLMNACYP3A4
Quizalofop SCHEMBL111413 0.82 ALDH1A1 (0.72) CYP1A2ALDH1A1MAPTLMNACYP3A4

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
EP-0148119-B1 AMIDES OF 2-PHENOXYPROPIONIC ACID CIBA-GEIGY AG (CH) 1989-05-03 — — EP claimed
US-4640703-A CONTROLLING GRASSES IN CROPS CIBA-GEIGY CORPORATION (US) 1987-02-03 — — US claimed
EP-0148119-A2 Amides of 2-phenoxypropionic acid CIBA-GEIGY AG (CH) 1985-07-10 — — EP claimed
EP-0148119-B1 AMIDES OF 2-PHENOXYPROPIONIC ACID CIBA-GEIGY AG (CH) 1989-05-03 — — EP disclosed
US-4759796-A Used together with a carrier and other adjuvant CIBA-GEIGY CORPORATION (US) 1988-07-26 — — US disclosed
US-4640703-A CONTROLLING GRASSES IN CROPS CIBA-GEIGY CORPORATION (US) 1987-02-03 — — US disclosed
EP-0148119-A2 Amides of 2-phenoxypropionic acid CIBA-GEIGY AG (CH) 1985-07-10 — — EP disclosed
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