SCHEMBL30912752

SCHEMBL30912752

CCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1N

nearest known ligand 0.84

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.84
EGFR P00533 18/20 0.69
AURKA O14965 1/20 0.69
ERBB2 P04626 1/20 0.69
INSR P06213 1/20 0.69
PDGFRB P09619 1/20 0.69
FLT4 P35916 1/20 0.69
KDR P35968 1/20 0.69
CLK1 P49759 1/20 0.69
EPHB4 P54760 1/20 0.69
TEK Q02763 1/20 0.69
AURKB Q96GD4 1/20 0.69
GRM1 Q13255 1/20 0.61

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
SCHEMBL26637 1.00 FBP1 (0.84) FBP1EGFRAURKAERBB2INSR
SCHEMBL26350 0.93 FBP1 (0.72) FBP1EGFRAURKAERBB2INSR
SCHEMBL17538494 0.91 FBP1 (0.70) FBP1EGFRAURKAERBB2INSR
SCHEMBL26593 0.90 FBP1 (0.71) FBP1EGFRAURKAERBB2INSR
SCHEMBL29362232 0.89 EGFR (0.83) FBP1EGFRAURKAERBB2INSR
SCHEMBL26876 0.89 EGFR (0.83) FBP1EGFRAURKAERBB2INSR
SCHEMBL17538554 0.89 FBP1 (0.67) FBP1EGFRAURKAERBB2INSR
SCHEMBL6994526 0.89 EGFR (0.69) FBP1EGFRAURKAERBB2INSR
SCHEMBL24377 0.88 EGFR (0.66) FBP1EGFRAURKAERBB2INSR
SCHEMBL15928219 0.88 FBP1 (0.66) FBP1EGFRAURKAERBB2INSR

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
CN-118142359-A Anti-pollution and oxidation-resistant reverse osmosis membrane with low-surface-energy coating and preparation method thereof 万华化学集团股份有限公司 2024-06-07 CN claimed
CN-118142359-A Anti-pollution and oxidation-resistant reverse osmosis membrane with low-surface-energy coating and preparation method thereof 万华化学集团股份有限公司 2024-06-07 CN disclosed