SCHEMBL2805533

SCHEMBL2805533

Clc1ccccc1C1Cc2cnc(NCCc3c[nH]cn3)nc2-c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 8/20 0.40
FGFR2 P21802 3/20 0.40
FGFR3 P22607 2/20 0.40
CSF1R P07333 1/20 0.40
KDR P35968 2/20 0.34
PLK1 P53350 1/20 0.34
CDK1 P06493 1/20 0.32
ADORA1 P30542 3/20 0.32
EGFR P00533 3/20 0.32
SRC P12931 3/20 0.32
FGFR4 P22455 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
LMNA P02545 1/20 0.31
SLC6A4 P31645 1/20 0.31
HRH3 Q9Y5N1 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
SCHEMBL2807909 0.89 FGFR1 (0.44) FGFR1FGFR2FGFR3CSF1RKDR
SCHEMBL2804107 0.89 FGFR1 (0.51) FGFR1FGFR2FGFR3CSF1R
SCHEMBL2807673 0.89 FGFR1 (0.52) FGFR1FGFR2FGFR3CSF1RKDR
SCHEMBL2802766 0.85 FGFR1 (0.44) FGFR1FGFR2FGFR3CSF1RKDM4E
SCHEMBL2805123 0.84 FGFR1 (0.43) FGFR1FGFR2FGFR3CSF1RADORA1
SCHEMBL2805024 0.81 FGFR1 (0.44) FGFR1FGFR2FGFR3CSF1RADORA1
SCHEMBL2805712 0.81 FGFR1 (0.46) FGFR1FGFR2FGFR3CSF1RKDR
SCHEMBL17057491 0.81 FGFR1 (0.45) FGFR1FGFR2FGFR3CSF1RADORA1
SCHEMBL2803090 0.80 FGFR1 (0.54) FGFR1FGFR2FGFR3CSF1RKDM4E
SCHEMBL2804113 0.79 FGFR1 (0.46) FGFR1FGFR2FGFR3EGFRSRC

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 511/4885FGFR3 521/4885

“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.