SCHEMBL2804584

SCHEMBL2804584

CCN(CC)CCCNc1ncc2c(n1)-c1ccccc1C(c1ccc(Cl)cc1)C2

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 14/20 0.44
FGFR2 P21802 4/20 0.44
EGFR P00533 3/20 0.42
FGFR3 P22607 3/20 0.42
SRC P12931 2/20 0.42
FGFR4 P22455 2/20 0.42
CCR4 P51679 1/20 0.40
SLC2A1 P11166 1/20 0.39
ADORA1 P30542 2/20 0.38
APAF1 O14727 1/20 0.38
NPC1 O15118 1/20 0.38
MITF O75030 1/20 0.38
NSD2 O96028 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
CSF1R P07333 1/20 0.38

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
SCHEMBL2803180 0.93 FGFR1 (0.53) FGFR1FGFR2EGFRFGFR3SRC
SCHEMBL2802959 0.91 FGFR1 (0.44) FGFR1FGFR2EGFRFGFR3SRC
SCHEMBL2805027 0.91 FGFR1 (0.46) FGFR1FGFR2FGFR3ADORA1CSF1R
SCHEMBL2804101 0.89 FGFR1 (0.51) FGFR1FGFR2EGFRFGFR3SRC
SCHEMBL2804796 0.89 FGFR1 (0.49) FGFR1FGFR2EGFRFGFR3SRC
SCHEMBL2802801 0.88 FGFR1 (0.43) FGFR1FGFR2EGFRFGFR3SRC
SCHEMBL2804590 0.85 FGFR1 (0.47) FGFR1FGFR2FGFR3ADORA1MAPT
SCHEMBL2805149 0.84 FGFR1 (0.48) FGFR1FGFR2EGFRFGFR3SRC
SCHEMBL2806391 0.83 FGFR1 (0.51) FGFR1FGFR2FGFR3ADORA1MAPT
SCHEMBL2805147 0.83 FGFR1 (0.55) FGFR1FGFR2FGFR3SLC2A1ADORA1

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 8 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
US-20100239525-A1 SUBSTITUTED 5,6-DIHYDRO-6-PHENYLBENZO[F]ISOQUINOLIN-2-AMINE COMPOUNDS ARQULE, INC. (US) 2010-09-23 US disclosed
WO-2010078421-A1 SUBSTITUTED 5,6-DIHYDRO-6-PHENYLBENZO[F] ISOQUINOLIN-2-AMINE COMPOUNDS ARQULE, INC. (US) 2010-07-08 WO 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 511/4885EGFR 1297/4885

“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.