SCHEMBL15045724

SCHEMBL15045724

COc1cc(C)cc2cc(-c3c(CNCCNC(C)=O)cn4ncnc(N)c34)sc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 20/20 1.00

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
Trifluoroacetic Acid SCHEMBL16568230 0.95 FGFR1 (0.90) FGFR1
SCHEMBL15045727 0.93 FGFR1 (1.00) FGFR1
SCHEMBL15045670 0.89 FGFR1 (1.00) FGFR1
Hydrochloric Acid SCHEMBL16568507 0.89 FGFR1 (0.98) FGFR1
SCHEMBL15045652 0.89 FGFR1 (1.00) FGFR1
SCHEMBL15019449 0.88 FGFR1 (1.00) FGFR1
SCHEMBL15045671 0.88 FGFR1 (1.00) FGFR1
Hydrochloric Acid SCHEMBL16568552 0.87 FGFR1 (0.98) FGFR1
SCHEMBL16568233 0.87 FGFR1 (0.77) FGFR1
SCHEMBL15045662 0.86 FGFR1 (1.00) FGFR1

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
US-9598416-B2 Substituted benzothienyl-pyrrolotriazines and uses thereof in the treatment cancer BAYER INTELLECTUAL PROPERTY GMBH (DE) 2017-03-21 — — US disclosed
EP-2791143-B1 SUBSTITUTED BENZOTHIENYL-PYRROLOTRIAZINES AND USES THEREOF IN THE TREATMENT OF CANCER BAYER IP GMBH (DE) 2016-02-24 — — EP disclosed
WO-2013087647-A1 SUBSTITUTED BENZOTHIENYL - PYRROLOTRIAZINES AND USES THEREOF IN THE TREATMENT CANCER BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-06-20 — — WO disclosed
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