SCHEMBL7018992

SCHEMBL7018992

CCc1nc2c(C)nc(C)nc2n1-c1cccc(CCO)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 9/20 0.35
PLA2G2A P14555 2/20 0.35
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TLR8 Q9NR97 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
POLB P06746 1/20 0.31
PABPC1 P11940 1/20 0.31
PTGER4 P35408 1/20 0.30
MGLL Q99685 1/20 0.30

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
SCHEMBL1626307 0.85 MEN1 (0.39) SMN1; SMN2MEN1KMT2ACYP4F2CYP4A11
SCHEMBL3949910 0.72 MEN1 (0.38) SMN1; SMN2MEN1KMT2APOLBPABPC1
SCHEMBL1623477 0.69 GPR4 (0.43)
SCHEMBL1625960 0.68 FAAH (0.40) MAPTMEN1KMT2APOLBPABPC1
SCHEMBL1624749 0.68 MEN1 (0.37) MEN1KMT2A
SCHEMBL1624736 0.67 PTGER4 (0.57) MAPTMEN1KMT2ACYP4F2CYP4A11
SCHEMBL30513699 0.67 PTGER4 (0.57) MAPTMEN1KMT2ACYP4F2CYP4A11
SCHEMBL1625832 0.66 TSHR (0.36) MAPTSMN1; SMN2MEN1KMT2APOLB
SCHEMBL1625262 0.65 PPARG (0.42) MAPTTLR8MEN1KMT2ANR1H2
SCHEMBL1624649 0.64 MEN1 (0.43) MAPTMEN1KMT2ACYP4F2CYP4A11

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-1326864-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed