SCHEMBL7572002

SCHEMBL7572002

COc1cc2c(=O)[nH]cnc2cc1OCC(O)CN1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 2/20 0.51
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
KMT2A Q03164 1/20 0.50
AURKA O14965 1/20 0.50
TSHR P16473 1/20 0.49
POLB P06746 1/20 0.46
ADRB2 P07550 1/20 0.46
ABCB1 P08183 9/20 0.44
EGFR P00533 2/20 0.43
ATM Q13315 1/20 0.43

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
SCHEMBL4380606 0.99 FGFR2 (0.50) FGFR2KDM4EMEN1NPC1KMT2A
SCHEMBL4380603 0.99 FGFR2 (0.50) FGFR2KDM4EMEN1NPC1KMT2A
SCHEMBL5458902 0.91 BRD4 (0.49) FGFR2KDM4EMEN1NPC1KMT2A
SCHEMBL5217568 0.90 EGFR (0.53) FGFR2MEN1KMT2ATSHRADRB2
SCHEMBL4371030 0.84 ABCB1 (0.43) FGFR2AURKAABCB1
SCHEMBL4371022 0.84 ABCB1 (0.43) FGFR2AURKAABCB1
SCHEMBL4380551 0.82 EHMT2 (0.53) EGFR
SCHEMBL2924579 0.81 EHMT2 (0.60)
SCHEMBL5498950 0.81 EHMT2 (0.54) EGFR
SCHEMBL4686452 0.80 EHMT2 (0.61)

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-2002092577-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-11-21 WO disclosed