SCHEMBL9249346

SCHEMBL9249346

O=CNc1c(Cl)cc(F)cc1Cl

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL2097678 0.81 ERN1 (0.40) ALDH1A1
SCHEMBL2097245 0.76 ERN1 (0.40) ALDH1A1
SCHEMBL10877523 0.74 VCAM1 (0.37)
SCHEMBL7528985 0.73 GAA (0.41) ALDH1A1
SCHEMBL22704981 0.72 GAA (0.32)
SCHEMBL10965986 0.72 ALDH1A1 (0.39) ALDH1A1
SCHEMBL14855436 0.72 KMT2A (0.43)
SCHEMBL2094079 0.71 ALDH1A1 (0.48) ALDH1A1
SCHEMBL23981950 0.70 MAPT (0.42) ALDH1A1
SCHEMBL9666686 0.69 CA12 (0.33) ALDH1A1

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-5393913-A N-formylanilines RHONE-POULENC INC. (US) 1995-02-28 US disclosed
EP-0599183-A1 Manufacturing of pesticides and intermediates RHONE-POULENC AGROCHIMIE (FR) 1994-06-01 EP disclosed
US-4511720-A HYPOTENSIVE AGENTS HOFFMANN-LA ROCHE INC. (US) 1985-04-16 US disclosed
US-4355033-A TREATMENT OF HYPERTENSION HOFFMAN-LA ROCHE INC. (US) 1982-10-19 US disclosed
EP-0002010-B1 DERIVATIVES OF 2-IMINO-IMIDAZOLIDINE, PROCESSES FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND INTERMEDIATES F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1982-07-14 EP disclosed
US-4244957-A HYPOTENSIVE AGENTS HOFFMAN-LA ROCHE INC. (US) 1981-01-13 US disclosed
EP-0002010-A1 Derivatives of 2-imino-imidazolidine, processes for their preparation, pharmaceutical compositions containing them and intermediates F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1979-05-30 EP disclosed