SCHEMBL6741471

SCHEMBL6741471

COc1cccc(-c2ccc3c(c2)NC(=O)/C3=C\c2ccccc2O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 9/20 0.61
FGFR1 P11362 5/20 0.59
PLK4 O00444 1/20 0.57
PLK1 P53350 1/20 0.57
EGFR P00533 4/20 0.55
PDGFRB P09619 4/20 0.55
KDR P35968 4/20 0.55
CHEK2 O96017 2/20 0.53
TUBB4A P04350 1/20 0.53
TUBB P07437 1/20 0.53
TUBA3C P0DPH7 1/20 0.53
TUBA1B P68363 1/20 0.53
TUBA4A P68366 1/20 0.53
TUBB4B P68371 1/20 0.53
TUBB3 Q13509 1/20 0.53
TUBB2A Q13885 1/20 0.53
TUBB8 Q3ZCM7 1/20 0.53
TUBA3E Q6PEY2 1/20 0.53
TUBA1A Q71U36 1/20 0.53
TUBA1C Q9BQE3 1/20 0.53

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
SCHEMBL14521213 1.00 CHEK1 (0.61) CHEK1FGFR1PLK4PLK1EGFR
SCHEMBL6741475 1.00 CHEK1 (0.61) CHEK1FGFR1PLK4PLK1EGFR
SCHEMBL6743609 0.87 MDM2 (0.57) CHEK1FGFR1EGFRPDGFRBKDR
SCHEMBL6743605 0.87 MDM2 (0.57) CHEK1FGFR1EGFRPDGFRBKDR
SCHEMBL14521214 0.87 CHEK1 (0.61) CHEK1FGFR1EGFRPDGFRBKDR
SCHEMBL14521211 0.83 CHEK1 (0.56) CHEK1FGFR1EGFRPDGFRBKDR
SCHEMBL4992390 0.83 CHEK1 (0.67) CHEK1FGFR1EGFRPDGFRBKDR
SCHEMBL4992383 0.83 CHEK1 (0.67) CHEK1FGFR1EGFRPDGFRBKDR
SCHEMBL14521215 0.82 CHEK1 (0.58) CHEK1FGFR1EGFRPDGFRBKDR
SCHEMBL14521212 0.81 CHEK1 (0.53) CHEK1FGFR1EGFRPDGFRBKDR

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
US-6689806-B1 MODULATING PROTEIN KINASES AND RELATED SIGNAL TRANSDUCTION PATHWAYS SUGEN, INC. 2004-02-10 US disclosed