SCHEMBL2804236

SCHEMBL2804236

CN(C)CCCCNc1ncc2c(n1)-c1ccccc1C(c1ccc(NC(=O)NC3c4ccccc4-c4ccccc43)cc1)C2

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 9/20 0.38
FGFR2 P21802 2/20 0.38
CSF1R P07333 1/20 0.38
FGFR3 P22607 1/20 0.38
NTRK1 P04629 3/20 0.37
NTRK3 Q16288 2/20 0.37
NTRK2 Q16620 1/20 0.37
EGFR P00533 1/20 0.37
IKBKB O14920 2/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
MERTK Q12866 2/20 0.34
NAMPT P43490 2/20 0.34

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
SCHEMBL2804284 0.91 FGFR1 (0.44) FGFR1FGFR2CSF1RFGFR3EGFR
SCHEMBL2805430 0.90 FGFR1 (0.45) FGFR1FGFR2CSF1RFGFR3EGFR
SCHEMBL2804914 0.90 FGFR1 (0.45) FGFR1FGFR2CSF1RFGFR3EGFR
SCHEMBL2805009 0.90 FGFR1 (0.41) FGFR1FGFR2CSF1RFGFR3EGFR
SCHEMBL2802460 0.90 FGFR1 (0.39) FGFR1FGFR2CSF1RFGFR3EGFR
SCHEMBL2805255 0.89 FGFR1 (0.44) FGFR1FGFR2CSF1RFGFR3EGFR
SCHEMBL16360137 0.88 FGFR1 (0.40) FGFR1FGFR2CSF1RFGFR3EGFR
SCHEMBL2803447 0.87 FGFR1 (0.39) FGFR1FGFR2CSF1RFGFR3NTRK1
SCHEMBL2805358 0.87 FGFR1 (0.42) FGFR1FGFR2NTRK2EGFRMERTK
SCHEMBL2804758 0.87 MEN1 (0.39) FGFR1FGFR2CSF1RFGFR3EGFR

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-2379506-B1 SUBSTITUTED 5,6-DIHYDRO-6-PHENYLBENZO[F]ISOQUINOLIN-2-AMINE COMPOUNDS ARQULE INC (US) 2015-09-02 EP disclosed
EP-2379506-B1 SUBSTITUTED 5,6-DIHYDRO-6-PHENYLBENZO[F]ISOQUINOLIN-2-AMINE COMPOUNDS ARQULE INC (US) 2015-09-02 EP disclosed
US-8357694-B2 Substituted 5,6-dihydro-6-phenylbenzo[F]isoquinolin-2-amine compounds ARQULE, INC. (US) 2013-01-22 US disclosed
US-8357694-B2 Substituted 5,6-dihydro-6-phenylbenzo[F]isoquinolin-2-amine compounds ARQULE, INC. (US) 2013-01-22 US disclosed
US-8357694-B2 Substituted 5,6-dihydro-6-phenylbenzo[F]isoquinolin-2-amine compounds ARQULE, INC. (US) 2013-01-22 US disclosed
US-20100239525-A1 SUBSTITUTED 5,6-DIHYDRO-6-PHENYLBENZO[F]ISOQUINOLIN-2-AMINE COMPOUNDS ARQULE, INC. (US) 2010-09-23 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-20100239525-A1 SUBSTITUTED 5,6-DIHYDRO-6-PHENYLBENZO[F]ISOQUINOLIN-2-AMINE COMPOUNDS NQO1, DPYD, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 FGFR1 530/4885FGFR2 511/4885CSF1R 4606/4885

“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.