SCHEMBL885793

SCHEMBL885793

CN(C)CCOc1cccc(-c2cc3cc(N(C)c4cc(C(=O)NC5CC5)ccc4F)cnc3[nH]2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.42
MCHR1 Q99705 4/20 0.38
DYRK3 O43781 1/20 0.38
MAP4K4 O95819 1/20 0.38
PIM1 P11309 1/20 0.38
RPS6KB1 P23443 1/20 0.38
CSNK2A1 P68400 1/20 0.38
PKN2 Q16513 1/20 0.38
PIM3 Q86V86 1/20 0.38
BRSK1 Q8TDC3 1/20 0.38
AURKB Q96GD4 1/20 0.38
HIPK2 Q9H2X6 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
STK17A Q9UEE5 1/20 0.38
MAP4K5 Q9Y4K4 1/20 0.38
HTR7 P34969 1/20 0.38
ULK1 O75385 2/20 0.37
CHEK2 O96017 1/20 0.37
HDAC1 Q13547 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 0.86 RIPK1 (0.52) RIPK1MCHR1ULK1GRM5RAB9A
SCHEMBL885792 0.85 HDAC1 (0.43) RIPK1MCHR1DYRK3MAP4K4PIM1
SCHEMBL885700 0.84 RIPK1 (0.53) RIPK1MCHR1GRM5GABRA5
SCHEMBL2060253 0.84 RIPK1 (0.48) RIPK1MCHR1ULK1HPGDSGRM5
SCHEMBL2060124 0.80 RIPK1 (0.47) RIPK1MCHR1GRM5RAB9ASMN1; SMN2
SCHEMBL885847 0.79 RIPK1 (0.48) RIPK1MCHR1ULK1HPGDSGRM5
SCHEMBL885593 0.77 MCHR1 (0.45) RIPK1MCHR1HPGDSGRM5RAB9A
SCHEMBL885585 0.75 RIPK1 (0.45) RIPK1MCHR1MAP4K4ULK1
SCHEMBL885846 0.74 KDR (0.41) RIPK1MCHR1HDAC1GRM5SMN1; SMN2
SCHEMBL2060136 0.68 MCHR1 (0.46) MCHR1GRM5

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 850/4885MCHR1 1197/4885DYRK3 778/4885

“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.