SCHEMBL3685689

SCHEMBL3685689

Cc1cccc(CNC(=O)NC[C@H]2C[C@H](n3cc(-c4cccc(OCc5ccccc5)c4)c4c(N)ncnc43)C2)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 17/20 0.79
INSR P06213 6/20 0.63
LYN P07948 4/20 0.63
EGFR P00533 4/20 0.63
SRC P12931 3/20 0.63
LCK P06239 3/20 0.63
FGFR1 P11362 3/20 0.63
FLT4 P35916 3/20 0.63
KDR P35968 3/20 0.63
FLT3 P36888 3/20 0.63
ROCK2 O75116 3/20 0.63
KIT P10721 2/20 0.63
FLT1 P17948 2/20 0.63
ERBB4 Q15303 2/20 0.63
RET P07949 2/20 0.63
ACVR1 Q04771 2/20 0.63
AURKA O14965 2/20 0.63
CHEK2 O96017 2/20 0.63
CSF1R P07333 2/20 0.63
RPS6KB1 P23443 2/20 0.63

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
SCHEMBL3687238 1.00 IGF1R (0.79) IGF1RINSRLYNEGFRSRC
SCHEMBL3685686 1.00 IGF1R (0.79) IGF1RINSRLYNEGFRSRC
SCHEMBL1985347 0.94 IGF1R (0.83) IGF1RINSRLYNEGFRSRC
SCHEMBL1985348 0.94 IGF1R (0.83) IGF1RINSRLYNEGFRSRC
SCHEMBL1987332 0.91 IGF1R (0.78) IGF1RINSRLYNEGFRSRC
SCHEMBL1987334 0.91 IGF1R (0.78) IGF1RINSRLYNEGFRSRC
SCHEMBL1984543 0.91 IGF1R (0.84) IGF1RINSRLYNEGFRSRC
SCHEMBL1984545 0.91 IGF1R (0.84) IGF1RINSRLYNEGFRSRC
SCHEMBL1988562 0.91 IGF1R (0.84) IGF1RINSRLYNEGFRSRC
SCHEMBL1985148 0.90 IGF1R (0.86) IGF1RINSRLYNEGFRSRC

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7326699-B2 4-Amino-5-phenyl-7-cyclobutyl-pyrrolo(2,3-d)pyrimidine derivatives NOVARTIS AG (CH) 2008-02-05 US claimed
EP-1390369-B1 4-AMINO-5-PHENYL-7-CYCLOBUTYL-PYRROLO(2,3-D)PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2005-11-09 EP claimed
US-20210369714-A1 Prevention and Treatment of Osteoarthritis by Inhibition of Insulin Growth Factor-1 Signaling NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-12-02 US disclosed
US-7781393-B2 Methods for inhibiting tumor cell growth DANA-FARBER CANCER INSTITUTE, INC. (US) 2010-08-24 US disclosed
US-7326699-B2 4-Amino-5-phenyl-7-cyclobutyl-pyrrolo(2,3-d)pyrimidine derivatives NOVARTIS AG (CH) 2008-02-05 US disclosed
EP-1476192-B1 METHODS AND COMPOSITIONS FOR TREATING HYPERPROLIFERATIVE CONDITIONS DANA FARBER CANCER INST INC (US) 2007-04-25 EP disclosed
EP-1737493-A2 INHIBITORS OF INSULIN-LIKE GROWTH FACTOR RECEPTOR -1 FOR INHIBITING TUMOUR CELL GROWTH DANA-FARBER CANCER INSTITUTE, INC. (US) 2007-01-03 EP disclosed
EP-1390369-B1 4-AMINO-5-PHENYL-7-CYCLOBUTYL-PYRROLO(2,3-D)PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2005-11-09 EP disclosed
US-20050215564-A1 Methods and compositions for treating hyperproliferative conditions DANA-FARBER CANCER INSTITUTE INC. 2005-09-29 US disclosed
WO-2005082415-A2 INHIBITORS OF INSULIN-LIKE GROWTH FACTOR RECEPTOR-1 FOR INHIBITING TUMOR CELL GROWTH DANA FARBER CANCER INSTITUTE, INC. (US) 2005-09-09 WO disclosed
US-20040180911-A1 4-Amino-5-phenyl-7-cyclobutyl-pyrrolo(2,3-d)pyrimidine derivatives NOVARTIS AG (CH) 2004-09-16 US disclosed
EP-1390369-A1 4-AMINO-5-PHENYL-7-CYCLOBUTYL-PYRROLO(2,3-D)PYRIMIDINE DERIVATIVES Novartis AG (CH) 2004-02-25 EP disclosed
WO-2002092599-A1 4-AMINO-5-PHENYL-7-CYCLOBUTYL-PYRROLO (2,3-D) PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2002-11-21 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-20040180911-A1 4-Amino-5-phenyl-7-cyclobutyl-pyrrolo(2,3-d)pyrimidine derivatives TYMP, DPYD, TYMS IGF1R 3898/4885INSR 2996/4885LYN 2065/4885

“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.