SCHEMBL23398685

SCHEMBL23398685

CCCc1cn(C)nc1O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.35
PTPN11 Q06124 1/20 0.35
HMGCR P04035 1/20 0.34
PRKCI P41743 1/20 0.32
MAPK10 P53779 1/20 0.31

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
SCHEMBL23399118 0.88 TYR (0.40)
SCHEMBL18083215 0.82
SCHEMBL23399728 0.82 L3MBTL1 (0.36) HMGCR
SCHEMBL23400208 0.79 L3MBTL1 (0.45) PTPN1PTPN11HMGCRPRKCI
SCHEMBL23400968 0.79 KDR (0.36)
SCHEMBL12094465 0.78 L3MBTL1 (0.40)
SCHEMBL291620 0.78 USP2 (0.32) MAPK10
SCHEMBL26777205 0.76 CYP19A1 (0.32)
SCHEMBL23403108 0.76 HMGCR (0.31) HMGCR
SCHEMBL23401258 0.74 ACHE (0.33)

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
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed