SCHEMBL1671385

SCHEMBL1671385

NC(=O)C(c1ccccc1)c1ccc(-n2nc(C3CC3)cc2C2CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CRACR2A Q9BSW2 9/20 0.55
ORAI1 Q96D31 4/20 0.46
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KCNJ6 P48051 4/20 0.41
KCNJ3 P48549 4/20 0.41
KCNJ5 P48544 1/20 0.40

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
SCHEMBL1670487 0.75 CRACR2A (0.54) CRACR2AORAI1
SCHEMBL1668597 0.73 CRACR2A (0.52) CRACR2AORAI1NPC1LMNATP53
SCHEMBL1671387 0.71 CRACR2A (1.00) CRACR2AORAI1NPC1RAB9ASMN1; SMN2
SCHEMBL1879322 0.70 CRACR2A (0.67) CRACR2AORAI1LMNAKCNJ6KCNJ3
SCHEMBL28073682 0.70 CRACR2A (0.51) CRACR2AORAI1NPC1LMNATP53
SCHEMBL1666818 0.69 CRACR2A (0.58) CRACR2AORAI1LMNAPKM
SCHEMBL23203519 0.69 KCNJ6 (0.65) NPC1LMNATP53PKMRAB9A
SCHEMBL30672491 0.69 NPC1 (0.51) CRACR2ANPC1LMNATP53PKM
SCHEMBL28073675 0.68 CRACR2A (0.51) CRACR2AORAI1KCNJ6KCNJ3
SCHEMBL1881601 0.68 CRACR2A (1.00) CRACR2AORAI1NPC1RAB9ASMN1; SMN2

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