SCHEMBL26987994

SCHEMBL26987994

FC(F)(F)CNc1ccc(Br)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AGER Q15109 1/20 0.42
▸ AR P10275 3/20 0.41
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ MAPT P10636 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ FPR3 P25089 1/20 0.38
▸ FPR2 P25090 1/20 0.38
▸ CYP2A6 P11509 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ ERBB2 P04626 1/20 0.35
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ HTT P42858 1/20 0.33
▸ CES1 P23141 1/20 0.33

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
SCHEMBL11556501 0.79 AR (0.39) ARMEN1KMT2AMAPTGAA
SCHEMBL11531629 0.78 MAPT (0.55) AGERMEN1KMT2AMAPTNPC1
SCHEMBL5400019 0.77 APP (0.43) ARMEN1KMT2AMAPTRAB9A
SCHEMBL924303 0.77 KIF11 (0.47) ARMAPTNPC1RAB9ACA1
SCHEMBL10426372 0.77 SMN1; SMN2 (0.44) ARMEN1KMT2ANPC1RAB9A
SCHEMBL7159847 0.77 APP (0.43) AGERARMEN1KMT2AMAPT
SCHEMBL12212268 0.77 MEN1 (0.43) AGERARMEN1KMT2AMAPT
SCHEMBL549076 0.76 ALDH1A1 (0.54) ARMAPTL3MBTL1MAPK1CA2
SCHEMBL19272212 0.76 CA12 (0.38) ARMEN1KMT2AMAPTNPC1
SCHEMBL17845230 0.74 POLB (0.48) MEN1KMT2AMAPTNPC1GAA

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
WO-2024008909-A1 INHIBITORS OF CORONAVIRUS JANSSEN PHARMACEUTICA NV (BE) 2024-01-11 — — WO disclosed
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