SCHEMBL8522893

SCHEMBL8522893

Cc1cccc(Nc2ncnc3cc4c(cc23)ncn4CCCN(C)C)c1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 17/20 0.72
▸ ERBB2 P04626 3/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ HTT P42858 1/20 0.48
▸ HIF1A Q16665 1/20 0.48

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
SCHEMBL8315445 0.81 EGFR (0.77) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL8310883 0.74 EGFR (0.66) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL13514653 0.72 EGFR (0.45) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL4347143 0.72 EGFR (0.61) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL18731437 0.71 LMNA (0.47) HTT
SCHEMBL8871648 0.71 EGFR (0.78) EGFRERBB2MAPK1HIF1A
Bromide SCHEMBL8871028 0.71 EGFR (0.60) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL8870421 0.71 EGFR (0.66) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL8315324 0.70 EGFR (0.61) EGFRERBB2MAPK1
SCHEMBL8871863 0.70 EGFR (0.82) EGFRERBB2MAPK1HTTHIF1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635507-B1 Tricyclic derivatives and their use as anti-cancer agents ZENECA LTD (GB) 1999-09-15 — — EP disclosed
US-5569658-A Tricyclic derivatives ZENECA LIMITED (GB) 1996-10-29 — — US disclosed
EP-0635507-A1 Tricyclic derivatives and their use as anti-cancer agents ZENECA LIMITED (GB) 1995-01-25 — — EP disclosed
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