SCHEMBL19485564

SCHEMBL19485564

C[C@H]1c2c(C3CCN(c4cc(C(F)(F)F)ccn4)CC3)n[nH]c2NC(=O)[C@H]1O

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LCAT P04180 16/20 0.62
▸ ADRB1 P08588 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.41
▸ MAPT P10636 1/20 0.41

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
SCHEMBL18138653 0.89 LCAT (0.75) LCAT
SCHEMBL18138550 0.89 LCAT (0.75) LCAT
SCHEMBL18138652 0.89 LCAT (0.75) LCAT
SCHEMBL19485568 0.81 LCAT (0.62) LCAT
SCHEMBL19485091 0.81 LCAT (0.63) LCATMAPT
SCHEMBL19485567 0.78 LCAT (0.65) LCAT
SCHEMBL19485396 0.78 LCAT (0.65) LCAT
SCHEMBL19485388 0.78 LCAT (0.49) LCATADRB1FFAR4HRH3
SCHEMBL19485369 0.77 LCAT (0.47) LCAT
SCHEMBL16648617 0.77 LCAT (0.73) LCAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9796709-B2 5-hydroxy-4-(trifluoromethyl)pyrazolopyridine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-10-24 — — US disclosed
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