SCHEMBL4585589

SCHEMBL4585589

Oc1nccc(-c2c(-c3ccc(F)cc3)ncn2C2CCNCC2)n1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.80
PRKD3 O94806 2/20 0.80
MAP4K4 O95819 2/20 0.80
PRKACA P17612 2/20 0.80
CSNK1A1 P48729 2/20 0.80
CSNK1D P48730 2/20 0.80
MINK1 Q8N4C8 2/20 0.80
MAP4K5 Q9Y4K4 2/20 0.80
MAPK13 O15264 1/20 0.80
RIPK2 O43353 1/20 0.80
DYRK3 O43781 1/20 0.80
PRKCG P05129 1/20 0.80
LCK P06239 1/20 0.80
LYN P07948 1/20 0.80
RET P07949 1/20 0.80
PIM1 P11309 1/20 0.80
MAPK1 P28482 1/20 0.80
FLT4 P35916 1/20 0.80
KDR P35968 1/20 0.80
MAPK9 P45984 1/20 0.80

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
Trifluoroacetic Acid SCHEMBL7893693 0.92 MAPK14 (0.69) MAPK14PRKD3MAP4K4PRKACACSNK1A1
SCHEMBL8655729 0.90 MAPK14 (0.90) MAPK14PRKD3MAP4K4PRKACACSNK1A1
Sb-220025 SCHEMBL173441 0.89 MAPK14 (1.00) MAPK14PRKD3MAP4K4PRKACACSNK1A1
SCHEMBL7772152 0.89 MAPK14 (0.82) MAPK14PRKD3MAP4K4PRKACACSNK1A1
Sb-220025 SCHEMBL18066291 0.88 MAPK14 (0.98) MAPK14PRKD3MAP4K4PRKACACSNK1A1
SCHEMBL7136557 0.87 MAPK14 (0.77) MAPK14PRKD3MAP4K4PRKACACSNK1A1
SCHEMBL4915514 0.87 MAPK14 (0.80) MAPK14PRKD3MAP4K4PRKACACSNK1A1
SCHEMBL4915688 0.84 MAPK14 (0.73) MAPK14PRKD3MAP4K4PRKACACSNK1A1
SCHEMBL1640306 0.84 MAPK14 (1.00) MAPK14PRKD3MAP4K4PRKACACSNK1A1
SCHEMBL13167691 0.84 MAPK14 (0.81) MAPK14PRKD3MAP4K4PRKACACSNK1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539121-A4 METHODS OF PROMOTING OSTEOGENESIS SCIOS INC (US) 2008-08-13 EP disclosed
US-20080108658-A1 METHODS OF PROMOTING OSTEOGENESIS PROTTER ANDREW A 2008-05-08 US disclosed
US-20080039461-A1 Treatment of pain by inhibition of p38 map kinase PROTTER ANDREW A 2008-02-14 US disclosed
US-7268139-B2 Methods of promoting osteogenesis SCIOS, INC. (US) 2007-09-11 US disclosed
US-7244441-B2 Stents and intra-luminal prostheses containing map kinase inhibitors SCIOS, INC. (US) 2007-07-17 US disclosed
EP-1676574-A2 Methods for promoting survival of transplanted tissues and cells Johnson & Johnson Vision Care, Inc. (US) 2006-07-05 EP disclosed
US-20060019971-A1 Treatment of cardiovascular disease with inhibitors of p38 kinase SCIOS INC. 2006-01-26 US disclosed
US-20050129729-A1 Stents and intra-luminal prostheses containing map kinase inhibitors SCIOS, INC. 2005-06-16 US disclosed
EP-1539121-A2 METHODS OF PROMOTING OSTEOGENESIS SCIOS INC. (US) 2005-06-15 EP disclosed
US-20040171659-A1 Methods for treating diabetes SCIOS, INC. 2004-09-02 US disclosed
US-20040162289-A1 Methods of promoting osteogenesis UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY 2004-08-19 US disclosed
US-20040122008-A1 Treatment of pain by inhibition of p38 MAP kinase SCIOS, INC. 2004-06-24 US disclosed
WO-2004019873-A2 METHODS OF PROMOTING OSTEOGENESIS SCIOS INC. (US) 2004-03-11 WO disclosed
US-6214844-B1 ANTIARTHRITIC AGENTS; BONE DISORDERS; ANTIINFLAMMATORY AGENTS SMITHKLINE BEECHAM CORPORATION 2001-04-10 US disclosed
US-6096739-A Treatment for CNS injuries SMITHKLINE BEECHAM CORPORATION (US) 2000-08-01 US disclosed
US-5811549-A Process of preparing imidazole compounds SMITHKLINE BEECHAM (US) 1998-09-22 US disclosed
US-5716955-A Substituted imidazole compounds SMITHKLINE BEECHAM CORPORATION (US) 1998-02-10 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 (6 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-20060019971-A1 Treatment of cardiovascular disease with inhibitors of p38 kinase MAPKAPK5, MAPK1, MAPKAPK2 MAPK14 36/4885PRKD3 117/4885MAP4K4 32/4885
US-20080108658-A1 METHODS OF PROMOTING OSTEOGENESIS MAPK1, BMP2, MAPK3 MAPK14 23/4885PRKD3 196/4885MAP4K4 55/4885
US-20040162289-A1 Methods of promoting osteogenesis MAPK1, BMP2, MAPK3 MAPK14 23/4885PRKD3 196/4885MAP4K4 55/4885
US-20040122008-A1 Treatment of pain by inhibition of p38 MAP kinase OPRK1, OPRL1, MAPK3 MAPK14 36/4885PRKD3 568/4885MAP4K4 37/4885
US-20080039461-A1 Treatment of pain by inhibition of p38 map kinase OPRK1, OPRL1, MAPK3 MAPK14 36/4885PRKD3 568/4885MAP4K4 37/4885
US-20040171659-A1 Methods for treating diabetes SLC5A2, MAPK4, MAPK3 MAPK14 53/4885PRKD3 232/4885MAP4K4 24/4885

“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.