SCHEMBL8216286

SCHEMBL8216286

ClC12C=CC(=N1)C(c1cnc3ccccc3c1)=c1ccc([nH]1)=C(c1cnc3ccccc3c1)C1=NC(=C(c3cccnc3)c3ccc([nH]3)C2(Cl)c2cnc3ccccc3c2)C=C1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 1/20 0.37
▸ KIT P10721 1/20 0.33

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
SCHEMBL8203836 1.00 CYP2A6 (0.37) CYP2A6KIT
SCHEMBL9641187 0.79 — —
SCHEMBL3190937 0.79 — —
Chloromethane SCHEMBL3670008 0.75 — —
Hydrochloric Acid SCHEMBL8203837 0.72 CYP2A6 (0.62) CYP2A6KIT
SCHEMBL9405181 0.71 — —
SCHEMBL7148663 0.68 — —
SCHEMBL7149929 0.66 — —
SCHEMBL8184161 0.65 — —
SCHEMBL5947696 0.65 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0988037-A1 PORPHYRIN COMPOUNDS AS TELOMERASE INHIBITORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2000-03-29 — — EP disclosed
WO-1998033503-A1 PORPHYRIN COMPOUNDS AS TELOMERASE INHIBITORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1998-08-06 — — WO disclosed
Send feedback