SCHEMBL29760199

SCHEMBL29760199

CC1(C)OB(c2cccnc2OC(F)(F)F)OC1(C)C

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 9/20 0.44
CXCR2 P25025 1/20 0.33
P2RY1 P47900 2/20 0.33
LPL P06858 3/20 0.33
LIPG Q9Y5X9 3/20 0.33
ROCK2 O75116 1/20 0.32
P2RY14 Q15391 1/20 0.32

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
SCHEMBL29108916 1.00 LIPE (0.44) LIPECXCR2P2RY1LPLLIPG
SCHEMBL20428078 0.85 LIPE (0.36) LIPEP2RY1LPLLIPGROCK2
SCHEMBL25300352 0.84 LIPE (0.42) LIPE
SCHEMBL29879749 0.84 LIPE (0.42) LIPE
SCHEMBL20428063 0.84 LIPE (0.35) LIPELPLLIPGROCK2
SCHEMBL22293781 0.83 LIPE (0.39) LIPEP2RY1ROCK2
SCHEMBL1484864 0.83 APLNR (0.38) LIPELPLLIPGROCK2
SCHEMBL30292561 0.83 APLNR (0.38) LIPELPLLIPGROCK2
SCHEMBL25426624 0.82 LIPE (0.55) LIPE
SCHEMBL23935943 0.82 LIPE (0.36) LIPEROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4308566-A1 PURINE DERIVATIVES AS ANTICANCER AGENTS Tango Therapeutics, Inc. (US) 2024-01-24 EP disclosed
EP-4267585-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS Actelion Pharmaceuticals Ltd (CH) 2023-11-01 EP disclosed
WO-2022197892-A1 PURINE DERIVATIVES AS ANTICANCER AGENTS TANGO THERAPEUTICS, INC. (US) 2022-09-22 WO disclosed
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 WO disclosed