SCHEMBL761901

SCHEMBL761901

C=COC(=O)c1cn2ncnc(N)c2c1-c1ccc(N)c(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 8/20 0.36
PIK3CD O00329 5/20 0.34
TNK2 Q07912 1/20 0.33
BTK Q06187 1/20 0.32
EGFR P00533 2/20 0.31
ERBB2 P04626 1/20 0.31
ABL1 P00519 1/20 0.31
HCK P08631 1/20 0.31
SRC P12931 1/20 0.31
KDR P35968 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 1/20 0.31
EPHB4 P54760 1/20 0.31
PRKDC P78527 1/20 0.31
PI4KB Q9UBF8 1/20 0.31
AURKA O14965 3/20 0.31
AURKB Q96GD4 3/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL762324 0.88 FGFR1 (0.36) FGFR1PIK3CDTNK2EGFRERBB2
SCHEMBL762162 0.87 FGFR1 (0.33) FGFR1PIK3CDTNK2BTKALDH1A1
SCHEMBL742983 0.84 EGFR (0.46) FGFR1EGFRERBB2KDRALDH1A1
SCHEMBL761907 0.79 KDM4E (0.38) FGFR1ABL1SRCKDREPHB4
SCHEMBL744946 0.76 FGFR1 (0.41) FGFR1AURKAAURKB
SCHEMBL27974841 0.74 ACVRL1 (0.38) FGFR1ALDH1A1CYP3A4TSHRMAPK1
SCHEMBL763960 0.74 FGFR1 (0.42) FGFR1PIK3CD
SCHEMBL762818 0.72 KDM4E (0.38) FGFR1EGFRKDRAURKAAURKB
SCHEMBL276495 0.72 EGFR (0.46) FGFR1EGFRERBB2KDR
SCHEMBL744286 0.72 EGFR (0.42) FGFR1EGFRERBB2KDRALDH1A1

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
US-8138336-B2 Pyrrolotriazine derivatives useful for treating cancer through inhibition of aurora kinase BAYER HEALTHCARE LLC (US) 2012-03-20 US disclosed
US-20100273800-A1 PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING CANCER THROUGH INHIBITION OF AURORA KINASE BAYER HEALTHCARE LLC 2010-10-28 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 (1 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-20100273800-A1 PYRROLOTRIAZINE DERIVATIVES USEFUL FOR TREATING CANCER THROUGH INHIBITION OF AURORA KINASE AURKC, AURKA, PLK1 FGFR1 776/4885PIK3CD 147/4885TNK2 53/4885

“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.