SCHEMBL1668268

SCHEMBL1668268

Cc1ncn(-c2ccc(-n3nc(C4CC4)cc3C(F)(F)F)cc2)c1C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRACR2A Q9BSW2 10/20 0.38
NPY5R Q15761 1/20 0.36
KCNJ6 P48051 3/20 0.35
KCNJ3 P48549 3/20 0.35
KCNJ5 P48544 1/20 0.35
TRPC3 Q13507 2/20 0.35
ORAI1 Q96D31 1/20 0.35
TRPC5 Q9UL62 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 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
SCHEMBL1668271 0.75 CRACR2A (0.35) CRACR2ANPY5RKCNJ6KCNJ3TRPC3
SCHEMBL28073663 0.75 CRACR2A (0.38) CRACR2ANPY5RKCNJ6KCNJ3TRPC3
SCHEMBL1885456 0.71 CRACR2A (0.76) CRACR2ATRPC3ORAI1TRPC5HPGD
SCHEMBL1668269 0.71 CRACR2A (0.50) CRACR2AKCNJ6KCNJ3TRPC3ORAI1
SCHEMBL12298698 0.69 CNR1 (0.48) CRACR2ANPY5RKCNJ6KCNJ3KCNJ5
SCHEMBL1668102 0.64 EPHX2 (0.74) CRACR2ATRPC3ORAI1SMN1; SMN2GAA
SCHEMBL31466256 0.63 GPR119 (0.54) HPGDSMN1; SMN2GAA
SCHEMBL31465902 0.62 P2RY14 (0.40) GAA
SCHEMBL2557636 0.62 NPC1 (0.63) NPY5RKCNJ6KCNJ3KCNJ5SMN1; SMN2
SCHEMBL7242808 0.61 ORAI1 (0.60) TRPC3ORAI1TRPC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2509955-A1 PYRAZOLE DERIVATIVES AS MODULATORS OF CALCIUM RELEASE -ACTIVATED CALCIUM CHANNEL Rhizen Pharmaceuticals S.A. (CH) 2012-10-17 EP disclosed
WO-2011042797-A1 PYRAZOLE DERIVATIVES AS MODULATORS OF CALCIUM RELEASE -ACTIVATED CALCIUM CHANNEL ICOZEN THERAPEUTICS PVT. LTD. (IN) 2011-04-14 WO disclosed