SCHEMBL23156292

SCHEMBL23156292

COc1ccc(Cn2cnnc2-c2[nH]nc(C)c2Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ QPCTL Q9NXS2 3/20 0.50
▸ P2RX7 Q99572 5/20 0.47
▸ GAA P10253 1/20 0.41
▸ GFER P55789 1/20 0.41
▸ PIK3R1 P27986 2/20 0.39
▸ PIK3CA P42336 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ CMA1 P23946 1/20 0.38
▸ CYP11B1 P15538 2/20 0.38
▸ CYP11B2 P19099 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL23156336 0.87 QPCTL (0.49) QPCTLP2RX7GAAGFERPIK3R1
SCHEMBL23156356 0.77 QPCTL (0.54) QPCTLP2RX7GAAGFERPIK3R1
SCHEMBL20413799 0.74 QPCTL (0.52) QPCTLP2RX7GAAGFERKDM4E
SCHEMBL23115720 0.74 QPCTL (0.46) QPCTLP2RX7KDM4EALDH1A1MAPT
SCHEMBL7512001 0.73 QPCTL (0.58) QPCTLP2RX7GAAGFERKDM4E
SCHEMBL14204032 0.70 QPCTL (0.48) QPCTLP2RX7KDM4EALDH1A1MAPT
SCHEMBL23116078 0.69 QPCTL (0.46) QPCTLP2RX7KDM4EALDH1A1MAPT
SCHEMBL26690111 0.68 QPCTL (0.45) QPCTLP2RX7GAAGFERKDM4E
SCHEMBL17982169 0.68 CYP11B2 (0.52) QPCTLP2RX7KDM4EALDH1A1MAPT
SCHEMBL23115689 0.68 QPCTL (0.49) QPCTLP2RX7KDM4EALDH1A1MAPT

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-2021059136-A1 POLYHETEROCYCLIC MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) PFIZER INC. (US) 2021-04-01 — — WO disclosed
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