SCHEMBL5507490

SCHEMBL5507490

Nc1c(F)ccc2c(N)c(F)c(F)cc12

nearest known ligand 0.30

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
SCHEMBL5515482 0.85 CA12 (0.35) ALDH1A1
SCHEMBL5506924 0.83 ALDH1A1 (0.33) ALDH1A1
SCHEMBL5508766 0.81 HSD17B1 (0.33)
SCHEMBL5508706 0.77
SCHEMBL5517966 0.74 ALDH1A1 (0.48) ALDH1A1
SCHEMBL5508448 0.73 CES2 (0.30)
SCHEMBL111957 0.72 CES2 (0.36) ALDH1A1
SCHEMBL5513879 0.71 ALDH1A1 (0.38) ALDH1A1
SCHEMBL5507531 0.71 ALDH1A1 (0.33) ALDH1A1
SCHEMBL5510115 0.70 ERN1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7208559-B2 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2007-04-24 US disclosed
US-20060135712-A1 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2006-06-22 US disclosed