SCHEMBL10499524

SCHEMBL10499524

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ TP53 P04637 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ GMNN O75496 1/20 0.46
▸ APEX1 P27695 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ HTT P42858 5/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GLA P06280 1/20 0.35

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
SCHEMBL10500265 0.89 CYP1A2 (0.61) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL10499485 0.89 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL8508358 0.82 ALDH1A1 (0.51) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL9420221 0.82 ALDH1A1 (0.54) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL9586772 0.81 ALDH1A1 (0.56) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4
Hydrochloric Acid SCHEMBL10947367 0.81 ALDH1A1 (0.53) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL733453 0.80 MAPT (0.53) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL11299600 0.79 ALDH1A1 (0.52) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL10969382 0.79 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL10981472 0.79 ALDH1A1 (0.49) ALDH1A1MAPTSMN1; SMN2CYP1A2CYP3A4

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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