SCHEMBL2803623

SCHEMBL2803623

CNc1ncc2c(n1)-c1ccccc1C(c1ccc(N)cc1)C2

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.61
FGFR2 P21802 2/20 0.61
CSF1R P07333 1/20 0.40
FGFR3 P22607 1/20 0.40
LMNA P02545 3/20 0.37
CYP1A2 P05177 4/20 0.36
CYP3A4 P08684 4/20 0.36
GAA P10253 4/20 0.36
CYP2C19 P33261 3/20 0.36
MERTK Q12866 1/20 0.35
CCNA2 P20248 1/20 0.35
CDK2 P24941 1/20 0.35
KDM4E B2RXH2 8/20 0.34
ALDH1A1 P00352 6/20 0.34
POLB P06746 3/20 0.34
MAP4K4 O95819 1/20 0.34
MAPT P10636 5/20 0.33
HTT P42858 3/20 0.33
HPGD P15428 3/20 0.33
CYP2C9 P11712 2/20 0.33

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
SCHEMBL2804017 0.84 FGFR1 (0.85) FGFR1FGFR2CCNA2CDK2KDM4E
SCHEMBL2804835 0.83 FGFR1 (0.49) FGFR1FGFR2LMNACYP1A2CYP3A4
SCHEMBL2809551 0.83 FGFR1 (0.49) FGFR1FGFR2LMNACYP1A2CYP3A4
SCHEMBL2804218 0.83 FGFR1 (0.49) FGFR1FGFR2LMNACYP1A2CYP3A4
SCHEMBL2805586 0.81 FGFR1 (0.50) FGFR1FGFR2CSF1RFGFR3MERTK
SCHEMBL2804465 0.80 CYP1A2 (0.51) FGFR1FGFR2CSF1RFGFR3LMNA
SCHEMBL2486812 0.80 FGFR1 (0.49) FGFR1FGFR2FGFR3KDR
SCHEMBL2808949 0.80 FGFR1 (0.49) FGFR1FGFR2CSF1RFGFR3MERTK
SCHEMBL2802737 0.80 FGFR1 (0.48) FGFR1FGFR2CSF1RFGFR3MERTK
SCHEMBL2489256 0.79 FGFR1 (0.50) FGFR1FGFR2CSF1RFGFR3MERTK

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 7 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
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 511/4885CSF1R 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.