SCHEMBL2805407

SCHEMBL2805407

Fc1ccccc1[C@@H]1Cc2cnc(Nc3ccc(CCN4CCCCC4)cc3)nc2-c2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.57
FGFR1 P11362 1/20 0.57
FGFR2 P21802 1/20 0.57
FGFR3 P22607 1/20 0.57
CDK1 P06493 8/20 0.51
KDR P35968 8/20 0.51
IGF1R P08069 2/20 0.43
RET P07949 1/20 0.42
SLC6A4 P31645 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
AXL P30530 3/20 0.39
AURKA O14965 1/20 0.39
CCNA2 P20248 1/20 0.39
CDK2 P24941 1/20 0.39
CCNA1 P78396 1/20 0.39
BACE1 P56817 1/20 0.38
TP53 P04637 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
SCHEMBL2807004 1.00 CSF1R (0.57) CSF1RFGFR1FGFR2FGFR3CDK1
Hydrochloric Acid SCHEMBL2807795 0.99 CSF1R (0.56) CSF1RFGFR1FGFR2FGFR3CDK1
Hydrochloric Acid SCHEMBL2807792 0.99 CSF1R (0.56) CSF1RFGFR1FGFR2FGFR3CDK1
SCHEMBL2489984 0.90 CDK1 (0.50) CSF1RFGFR1FGFR2FGFR3CDK1
SCHEMBL2489982 0.90 CDK1 (0.50) CSF1RFGFR1FGFR2FGFR3CDK1
SCHEMBL2490693 0.90 CDK1 (0.52) CSF1RFGFR1FGFR2FGFR3CDK1
SCHEMBL14644913 0.90 CDK1 (0.52) CSF1RFGFR1FGFR2FGFR3CDK1
SCHEMBL2488697 0.89 CDK1 (0.48) CSF1RFGFR1FGFR2FGFR3CDK1
SCHEMBL13273725 0.89 CDK1 (0.48) CSF1RFGFR1FGFR2FGFR3CDK1
SCHEMBL13273913 0.89 CSF1R (0.65) CSF1RFGFR1FGFR2FGFR3CDK1

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.