SCHEMBL29344747

SCHEMBL29344747

COc1cc(CN(C)c2cc(Nc3cc(F)cc4c3OCCO4)nc3c(C(C)C)cnn23)cc(OC)c1OC

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 2/20 0.30
▸ CDK2 P24941 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
SCHEMBL29344744 0.93 — —
SCHEMBL29344739 0.92 CXCR3 (0.33) P2RX7CDK2
SCHEMBL29344717 0.89 CDK2 (0.33) CDK2
SCHEMBL29344749 0.88 P2RX7 (0.33) P2RX7
SCHEMBL29344741 0.86 CXCR3 (0.32) P2RX7
SCHEMBL29344736 0.85 CXCR3 (0.32) P2RX7
SCHEMBL29344684 0.82 POLB (0.30) —
SCHEMBL29344750 0.82 TYK2 (0.37) —
SCHEMBL29344871 0.81 PTPN1 (0.34) P2RX7
SCHEMBL29344732 0.80 P2RX7 (0.31) P2RX7

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-2024151992-A1 PREPARATION OF A TYK2 INHIBITOR VENTYX BIOSCIENCES, INC. (US) 2024-07-18 — — WO disclosed
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