SCHEMBL19664448

SCHEMBL19664448

Cc1cc(CN)ccc1OC(F)F

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 6/20 0.47
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
BACE1 P56817 10/20 0.37
CTSD P07339 1/20 0.37
BACE2 Q9Y5Z0 1/20 0.37
APP P05067 1/20 0.36

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
SCHEMBL15693312 0.84 ALDH1A1 (0.42) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL7909260 0.83 CSNK2A1 (0.47) CSNK2A1
SCHEMBL16957987 0.82 ALDH1A1 (0.44) MEN1ALDH1A1LMNAMAPTHTT
Hydrochloric Acid SCHEMBL2282287 0.81 CSNK2A1 (0.49) CSNK2A1
SCHEMBL2440368 0.80 CSNK2A1 (0.45) CSNK2A1
SCHEMBL4550407 0.79 CSNK2A1 (0.41) CSNK2A1BACE1CTSDBACE2
SCHEMBL3397681 0.79 ALDH1A1 (0.42) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL15711376 0.79 CSNK2A1 (0.61) CSNK2A1MEN1LMNAKMT2A
SCHEMBL17159711 0.79 MEN1 (0.40) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL13343804 0.79 CYP1A2 (0.45) CSNK2A1MEN1ALDH1A1LMNAMAPT

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
EP-2914597-B1 PYRAZOLOPYRIDINE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2017-12-06 EP disclosed