SCHEMBL8315445

SCHEMBL8315445

Cc1cccc(Nc2ncnc3cc4c(cc23)ncn4C)c1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 15/20 0.77
▸ ERBB2 P04626 2/20 0.59
▸ MAPK1 P28482 2/20 0.59
▸ HTT P42858 2/20 0.58
▸ HIF1A Q16665 1/20 0.58
▸ KDM4E B2RXH2 2/20 0.54
▸ LMNA P02545 1/20 0.54

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
SCHEMBL17931472 0.87 EGFR (1.00) EGFRERBB2MAPK1KDM4E
SCHEMBL4365259 0.84 EGFR (0.71) EGFRERBB2LMNA
Hydrochloric Acid SCHEMBL7665624 0.83 EGFR (0.70) EGFRERBB2LMNA
SCHEMBL8522893 0.81 EGFR (0.72) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL4525877 0.80 EGFR (0.71) EGFRERBB2LMNA
Hydrochloric Acid SCHEMBL6207449 0.79 EGFR (0.70) EGFRERBB2LMNA
SCHEMBL8871863 0.78 EGFR (0.82) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL8871418 0.77 EGFR (0.71) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL8315139 0.77 EGFR (0.55) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL3391554 0.75 EGFR (1.00) 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 6 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 claimed
US-5569658-A Tricyclic derivatives ZENECA LIMITED (GB) 1996-10-29 — — US claimed
EP-0635507-A1 Tricyclic derivatives and their use as anti-cancer agents ZENECA LIMITED (GB) 1995-01-25 — — EP claimed
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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