SCHEMBL2805153

SCHEMBL2805153

O=C(Nc1ncc2c(n1)-c1ccccc1C(c1ccc(Cl)c(Cl)c1)C2)OCCc1cccc(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.41
FGFR2 P21802 2/20 0.41
CSF1R P07333 1/20 0.41
FGFR3 P22607 1/20 0.41
NR3C2 P08235 1/20 0.37
S1PR1 P21453 4/20 0.36
S1PR5 Q9H228 4/20 0.36
GRK5 P34947 1/20 0.36
CDK8 P49336 1/20 0.36
EPAS1 Q99814 1/20 0.36
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
PDGFRA P16234 2/20 0.35
PIM1 P11309 1/20 0.35
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 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
SCHEMBL16360387 0.94 FGFR1 (0.42) FGFR1FGFR2CSF1RFGFR3NR3C2
SCHEMBL2804902 0.93 FGFR1 (0.39) FGFR1FGFR2CSF1RFGFR3NR3C2
SCHEMBL16360386 0.88 FGFR1 (0.40) FGFR1FGFR2CSF1RFGFR3LMNA
SCHEMBL2805604 0.87 FGFR1 (0.37) FGFR1FGFR2CSF1RFGFR3NR3C2
SCHEMBL2802291 0.86 FGFR1 (0.42) FGFR1FGFR2CSF1RFGFR3CDK8
SCHEMBL2803028 0.85 FGFR1 (0.41) FGFR1FGFR2CSF1RFGFR3LMNA
SCHEMBL2804806 0.85 FGFR1 (0.46) FGFR1FGFR2CSF1RFGFR3LMNA
SCHEMBL2805050 0.84 FGFR1 (0.39) FGFR1FGFR2CSF1RFGFR3LMNA
SCHEMBL14644877 0.84 FGFR1 (0.39) FGFR1FGFR2CSF1RFGFR3LMNA
SCHEMBL2803624 0.84 FGFR1 (0.42) FGFR1FGFR2CSF1RFGFR3LMNA

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 5 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
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.