SCHEMBL19902749

SCHEMBL19902749

CCc1ccccc1C(=N)Nc1c(F)cc(C#N)cc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PKM P14618 1/20 0.38
BCHE P06276 1/20 0.37
KAT6A Q92794 2/20 0.36
AURKA O14965 1/20 0.35
RPS6KA5 O75582 1/20 0.35
DRD1 P21728 1/20 0.35
FLT3 P36888 1/20 0.35
RPS6KA3 P51812 1/20 0.35
PRKAA2 P54646 1/20 0.35
ABAT P80404 1/20 0.35
PRKAA1 Q13131 1/20 0.35
RPS6KA2 Q15349 1/20 0.35
RPS6KA1 Q15418 1/20 0.35
TMEM97 Q5BJF2 1/20 0.35
RPS6KA6 Q9UK32 1/20 0.35
STK24 Q9Y6E0 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL16489247 0.80 NPC1 (0.44) MAPTSMN1; SMN2PKMKAT6ANPC1
SCHEMBL19902804 0.71 BLM (0.39) MAPTALDH1A1LMNA
SCHEMBL10622670 0.68 EGLN2 (0.41) MEN1KMT2AALDH1A1
SCHEMBL5763437 0.67 CLCN2 (0.41) MAPTSMN1; SMN2KAT6AKMT2ANPC1
SCHEMBL11452798 0.66 NPC1 (0.48) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL19902737 0.66 RAB9A (0.54) MAPTSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL6961935 0.66 GAA (0.46) MAPTKAT6AKMT2AALDH1A1HTT
SCHEMBL16489244 0.65 NPC1 (0.42) SMN1; SMN2NPC1RAB9A
SCHEMBL25121244 0.65 TTR (0.35) MAPTMEN1KMT2AALDH1A1
SCHEMBL18398312 0.65 TTR (0.44) MAPTMEN1KMT2AALDH1A1

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-3033337-B1 SUBSTITUTED IMIDAZOLES AS N-TYPE CALCIUM CHANNEL BLOCKERS JANSSEN PHARMACEUTICA NV (BE) 2018-02-28 EP disclosed