SCHEMBL16489371

SCHEMBL16489371

COc1cc(CCc2cc(NC(=O)c3ccc(N4C[C@H](C)C[C@H](C)C4)cc3)n[nH]2)cc(OC)c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 8/20 0.84
NTRK1 P04629 1/20 0.84
RET P07949 1/20 0.84
PDGFRB P09619 1/20 0.84
MARK3 P27448 1/20 0.84
TNK2 Q07912 1/20 0.84
DDR1 Q08345 1/20 0.84
MAP4K2 Q12851 1/20 0.84
MAP3K11 Q16584 1/20 0.84
DDR2 Q16832 1/20 0.84
MARK2 Q7KZI7 1/20 0.84
MAP4K3 Q8IVH8 1/20 0.84
MAP4K1 Q92918 1/20 0.84
AURKB Q96GD4 1/20 0.84
EIF2AK1 Q9BQI3 1/20 0.84
MAP3K20 Q9NYL2 1/20 0.84
STK26 Q9P289 1/20 0.84
TNIK Q9UKE5 1/20 0.84
MAP4K5 Q9Y4K4 1/20 0.84
FGFR2 P21802 13/20 0.51

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
Fexagratinib SCHEMBL15250892 0.91 FGFR1 (1.00) FGFR1NTRK1RETPDGFRBMARK3
Fexagratinib SCHEMBL29479542 0.91 FGFR1 (1.00) FGFR1NTRK1RETPDGFRBMARK3
Azd-4547 SCHEMBL22132858 0.91 FGFR1 (1.00) FGFR1NTRK1RETPDGFRBMARK3
Azd-4547 SCHEMBL15433983 0.91 FGFR1 (1.00) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL62562 0.90 FGFR1 (0.82) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL63830 0.87 FGFR1 (0.77) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL13574146 0.87 FGFR1 (0.77) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL13574162 0.87 FGFR1 (0.77) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL62894 0.86 FGFR1 (0.76) FGFR1NTRK1RETPDGFRBMARK3
SCHEMBL22651509 0.86 FGFR1 (0.90) FGFR1NTRK1RETPDGFRBMARK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11771698-B2 Methods of treating cholangiocarcinoma FOUNDATION MEDICINE, INC. (US) 2023-10-03 US disclosed
US-20170304313-A1 Therapeutic Combination For The Treatment Of Cancer NOVARTIS AG (CH) 2017-10-26 US disclosed
US-20160095842-A1 COMBINATION THERAPY CONTAINING A PI3K-ALPHA INHIBITOR AND FGFR KINASE INHIBITOR FOR TREATING CANCER NOVARTIS PHARMA AG (CH) 2016-04-07 US disclosed
US-20150051210-A1 Tyrosine Kinase Inhibitor Combinations and their Use NOVARTIS AG (CH) 2015-02-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150051210-A1 Tyrosine Kinase Inhibitor Combinations and their Use MET, FGFR3, FGFR1 FGFR1 3/4885NTRK1 106/4885RET 6/4885
US-20160095842-A1 COMBINATION THERAPY CONTAINING A PI3K-ALPHA INHIBITOR AND FGFR KINASE INHIBITOR FOR TREATING CANCER FGFR3, FGFR1, PIK3CA FGFR1 2/4885NTRK1 1716/4885RET 62/4885
US-20170304313-A1 Therapeutic Combination For The Treatment Of Cancer FGFR3, EGFR, FGFR2 FGFR1 7/4885NTRK1 375/4885RET 22/4885
US-11771698-B2 Methods of treating cholangiocarcinoma HCCS, PNLIP, LIPA FGFR1 1732/4885NTRK1 2894/4885RET 2804/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.