Sugi Predict

Sugi Predict / Compounds / SCHEMBL7251995

SCHEMBL7251995

SCHEMBL7251995

COc1cc2c(Nc3c(Cl)ccc4ccoc34)ncnc2cc1OCN1CCN(C)CC1.COc1cc2cnc(Nc3c(Cl)ccc4ccoc34)nc2cc1OCC1CCNCC1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 13/20 0.56
▸ SRC P12931 5/20 0.56
▸ CSK P41240 1/20 0.53
▸ TEK Q02763 1/20 0.53
▸ EGFR P00533 14/20 0.50
▸ FGFR1 P11362 7/20 0.50
▸ FLT1 P17948 7/20 0.50
▸ FLT4 P35916 7/20 0.50
▸ ERBB2 P04626 1/20 0.45
▸ EPHA2 P29317 1/20 0.45
▸ EPHB4 P54760 1/20 0.45

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
SCHEMBL6445304 0.86 KDR (0.66) KDRSRCCSKTEKEGFR
SCHEMBL6451233 0.85 KDR (0.44) KDRSRCCSKTEKEGFR
SCHEMBL6448196 0.85 KDR (0.74) KDRSRCCSKTEKEGFR
SCHEMBL6445791 0.79 KDR (0.66) KDRSRCCSKTEKEGFR
SCHEMBL6445013 0.79 KDR (0.80) KDRSRCCSKTEKEGFR
SCHEMBL3680310 0.78 KDR (0.87) KDRSRCCSKTEKEGFR
SCHEMBL7252484 0.76 KDR (0.66) KDRSRCCSKTEKEGFR
SCHEMBL6445629 0.74 KDR (0.67) KDRSRCFLT1ERBB2EPHA2
SCHEMBL6445635 0.74 KDR (0.67) KDRSRCFLT1ERBB2EPHA2
SCHEMBL6444241 0.74 KDR (0.59) KDRSRCCSKTEKEGFR

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-2002030924-A9 QUINAZOLINE DERIVATIVES WITH ANTI-TUMOUR ACTIVITY ASTRAZENECA AB (SE) 2003-05-22 — — WO disclosed