SCHEMBL2803988

SCHEMBL2803988

COc1ccc(C(=O)Nc2ccc(C3Cc4cnc(NCCCCN(C)C)nc4-c4ccccc43)cc2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.41
FGFR1 P11362 1/20 0.41
FGFR2 P21802 1/20 0.41
FGFR3 P22607 1/20 0.41
LCK P06239 1/20 0.41
BRAF P15056 4/20 0.41
NAMPT P43490 1/20 0.41
IGF1R P08069 5/20 0.40
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
KDR P35968 1/20 0.39
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
SELP P16109 1/20 0.37
TYRO3 Q06418 1/20 0.37
PTK2 Q05397 1/20 0.37

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
SCHEMBL2807926 0.89 CYP1A2 (0.46) CSF1RFGFR1FGFR2FGFR3LCK
SCHEMBL2805099 0.87 CYP1A2 (0.40) CSF1RFGFR1FGFR2FGFR3LCK
SCHEMBL2802594 0.85 FGFR1 (0.40) CSF1RFGFR1FGFR2FGFR3LCK
SCHEMBL2805089 0.85 FGFR1 (0.41) CSF1RFGFR1FGFR2FGFR3LCK
SCHEMBL2802870 0.84 SIRT2 (0.39) CSF1RFGFR1FGFR2FGFR3NAMPT
SCHEMBL14644933 0.84 SELP (0.40) CSF1RFGFR1FGFR2FGFR3IGF1R
SCHEMBL2805255 0.84 FGFR1 (0.44) CSF1RFGFR1FGFR2FGFR3KDR
SCHEMBL2802460 0.84 FGFR1 (0.39) CSF1RFGFR1FGFR2FGFR3NAMPT
SCHEMBL2802534 0.83 CNR1 (0.43) CSF1RFGFR1FGFR2FGFR3NAMPT
SCHEMBL2807820 0.83 FGFR1 (0.40) CSF1RFGFR1FGFR2FGFR3LCK

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 CSF1R 4606/4885FGFR1 530/4885FGFR2 511/4885

“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.