SCHEMBL9632174

SCHEMBL9632174

COc1ccc(CCCCNC(=O)C(F)(F)F)cc1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.54
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL5072982 0.96 POLB (0.58) POLBSMN1; SMN2
SCHEMBL140038 0.90 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1
SCHEMBL6541474 0.87 POLB (0.50) POLBSMN1; SMN2ALDH1A1
SCHEMBL4277213 0.85 POLB (0.48) POLBSMN1; SMN2
SCHEMBL4463389 0.82 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1
SCHEMBL506516 0.80 HDAC3 (0.60) SMN1; SMN2ALDH1A1
SCHEMBL12487022 0.80 CYP4A11 (0.59) POLBSMN1; SMN2ALDH1A1
SCHEMBL5073633 0.80 MTNR1A (0.71)
SCHEMBL3452433 0.79 POLB (0.68) POLBSMN1; SMN2
SCHEMBL4313502 0.79 POLB (0.44) POLBSMN1; SMN2ALDH1A1

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
EP-0331943-B1 PHENOXYETHYLAMINE DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND COMPOSITION FOR EXHIBITING EXCELLENT ALPHA-1-BLOCKING ACTIVITY CONTAINING THE SAME Hokuriku Pharmaceutical Co.,Ltd (JP) 1992-06-17 EP disclosed
US-4971990-A HYPOTENSIVE AGENTS, DYSUREA HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1990-11-20 US disclosed