SCHEMBL885585

SCHEMBL885585

CN(c1cnc2[nH]c(-c3ccccc3)cc2c1)c1cc(C(=O)NC2CC2)c(F)cc1F

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.45
KIT P10721 9/20 0.44
MCHR1 Q99705 2/20 0.38
BRAF P15056 1/20 0.38
MAP4K4 O95819 2/20 0.38
ULK1 O75385 2/20 0.37
BRD4 O60885 1/20 0.37
RIPK2 O43353 1/20 0.37
ADRA2A P08913 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
SCHEMBL2060043 0.88 RIPK1 (0.52) RIPK1KITMCHR1BRAFULK1
SCHEMBL885700 0.79 RIPK1 (0.53) RIPK1KITMCHR1RIPK2ADRA2A
SCHEMBL885586 0.78 KIT (0.50) RIPK1KITBRAFULK1
SCHEMBL2060253 0.78 RIPK1 (0.48) RIPK1MCHR1ULK1
SCHEMBL2060124 0.77 RIPK1 (0.47) RIPK1MCHR1ADRA2A
SCHEMBL885793 0.75 RIPK1 (0.42) RIPK1MCHR1MAP4K4ULK1
SCHEMBL885847 0.75 RIPK1 (0.48) RIPK1KITMCHR1ULK1
SCHEMBL885593 0.72 MCHR1 (0.45) RIPK1MCHR1ADRA2A
SCHEMBL18932414 0.70 ULK1 (0.52) RIPK1KITULK1BRD4
SCHEMBL885770 0.69 RIPK1 (0.53) RIPK1KITBRAF

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-2081928-B1 Pyrrolo-pyridine kinase inhibitors BRISTOL MYERS SQUIBB CO (US) 2014-02-26 EP claimed
US-8148361-B2 Kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-03 US claimed
US-20100041636-A1 NOVEL KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-18 US claimed
EP-2081928-A2 PYRROLO-PYRIDINE KINASE INHIBITORS Brystol-Myers Squibb Company (US) 2009-07-29 EP claimed
WO-2008060907-A2 PYRROLO-PYRIDINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-22 WO claimed
EP-2081928-B1 Pyrrolo-pyridine kinase inhibitors BRISTOL MYERS SQUIBB CO (US) 2014-02-26 EP disclosed
US-8148361-B2 Kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-03 US disclosed
US-20100041636-A1 NOVEL KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-18 US 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-20100041636-A1 NOVEL KINASE INHIBITORS IGF1R, FGFR1, FLT1 RIPK1 850/4885KIT 203/4885MCHR1 1197/4885

“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.