SCHEMBL2856892

SCHEMBL2856892

N#CCc1cccc(NC(=O)Oc2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.40
MAPT P10636 8/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPSR1 Q6W5P4 3/20 0.37
HSP90AA1 P07900 2/20 0.37
KDM4E B2RXH2 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BRAF P15056 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
TRPC1 P48995 1/20 0.35
TRPC3 Q13507 1/20 0.35
STIM1 Q13586 1/20 0.35
ORAI1 Q96D31 1/20 0.35

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
SCHEMBL2850631 0.86 P2RX1 (0.41) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL2850258 0.86 MAPT (0.51) CCR1MAPTMEN1KMT2ANPSR1
SCHEMBL2854221 0.84 MAPT (0.51) CCR1MAPTLMNAMEN1KMT2A
SCHEMBL2852565 0.84 MAPT (0.42) CCR1MAPTNPC1LMNAHTT
SCHEMBL2854572 0.84 RAB9A (0.44) CCR1MAPTNPC1MEN1KMT2A
SCHEMBL2853385 0.83 MAPT (0.42) CCR1MAPTMEN1KMT2ANPSR1
SCHEMBL2853258 0.83 NPY5R (0.45) CCR1MAPTNPC1MEN1KMT2A
SCHEMBL2852360 0.83 MAPT (0.42) CCR1MAPTMEN1KMT2ANPSR1
SCHEMBL2848615 0.83 MAPT (0.44) CCR1MAPTNPC1MEN1KMT2A
SCHEMBL2848317 0.83 MAPT (0.46) MAPTNPC1MEN1KMT2ANPSR1

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-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed