SCHEMBL2544927

SCHEMBL2544927

CCn1cc(-c2ccnc(Nc3cccc(N4CCOCC4)c3)n2)c2ccncc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.56
▸ ACVR1 Q04771 2/20 0.54
▸ CAMK2D Q13557 1/20 0.53
▸ CDK2 P24941 4/20 0.52
▸ CCNE1 P24864 2/20 0.52
▸ FLT3 P36888 2/20 0.52
▸ MAPK8 P45983 4/20 0.51
▸ MAPK10 P53779 4/20 0.51
▸ JAK3 P52333 1/20 0.51
▸ EGFR P00533 2/20 0.50
▸ MAPK9 P45984 1/20 0.49
▸ CDK1 P06493 2/20 0.48
▸ CCNB1 P14635 1/20 0.48
▸ CDK7 P50613 1/20 0.48
▸ CCNH P51946 1/20 0.48
▸ MNAT1 P51948 1/20 0.48
▸ DYRK3 O43781 1/20 0.47
▸ IGF1R P08069 1/20 0.47
▸ CLK1 P49759 1/20 0.47
▸ CLK2 P49760 1/20 0.47

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
SCHEMBL2542950 0.91 ACVR1 (0.61) JAK2ACVR1CAMK2DCDK2CCNE1
SCHEMBL2543915 0.90 ACVR1 (0.53) ACVR1CAMK2DCDK2CCNE1FLT3
SCHEMBL2227986 0.86 CCNT1 (0.54) JAK2ACVR1CAMK2DCDK2CCNE1
SCHEMBL2537277 0.86 CAMK2D (0.56) JAK2ACVR1CAMK2DCDK2CCNE1
SCHEMBL2545972 0.85 CAMK2D (0.54) JAK2ACVR1CAMK2DCDK2CCNE1
SCHEMBL2546292 0.85 CCNT1 (0.56) JAK2ACVR1CDK2FLT3EGFR
SCHEMBL2541347 0.84 ACVR1 (0.57) JAK2ACVR1CAMK2DCDK2CCNE1
SCHEMBL2546356 0.83 CDK2 (0.53) ACVR1CAMK2DCDK2CCNE1FLT3
SCHEMBL2543346 0.82 MKNK2 (0.51) CDK2EGFRCDK1CCNB1CDK7
SCHEMBL2543938 0.81 ACVR1 (0.61) JAK2ACVR1CDK2CCNE1FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140303163-A1 USE OF KINASE INHIBITORS IN PREVENTING AND TREATING INFLAMMATORY DISORDER LUO YING (CN) 2014-10-09 — — US claimed
CN-103608014-A Use of kinase inhibitors in preventing and treating inflammatory disorder LUO YING 2014-02-26 — — CN claimed
US-20110263541-A1 KINASE INHIBITORS AND THEIR USE AS PHARMACEUTICAL AGENTS SHANGHAI GENOMICS, INC (CN) 2011-10-27 — — US claimed
CN-101723936-A Kinase suppressor and pharmaceutical application thereof SHANGHAI GENOMICS INC 2010-06-09 — — CN claimed
US-20140303163-A1 USE OF KINASE INHIBITORS IN PREVENTING AND TREATING INFLAMMATORY DISORDER LUO YING (CN) 2014-10-09 — — US disclosed
CN-103608014-A Use of kinase inhibitors in preventing and treating inflammatory disorder LUO YING 2014-02-26 — — CN disclosed
CN-101723936-B Kinase suppressor and pharmaceutical application thereof SHANGHAI GENOMICS INC 2014-01-15 — — CN disclosed
US-8309550-B2 Kinase inhibitors and their use as pharmaceutical agents SHANGHAI GENOMICS, INC. (CN) 2012-11-13 — — US disclosed
US-20110263541-A1 KINASE INHIBITORS AND THEIR USE AS PHARMACEUTICAL AGENTS SHANGHAI GENOMICS, INC (CN) 2011-10-27 — — US disclosed
CN-101723936-A Kinase suppressor and pharmaceutical application thereof SHANGHAI GENOMICS INC 2010-06-09 — — CN 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 (2 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-20110263541-A1 KINASE INHIBITORS AND THEIR USE AS PHARMACEUTICAL AGENTS MAP3K20, MAP3K1, MAP3K2 JAK2 178/4885ACVR1 2914/4885CAMK2D 239/4885
US-20140303163-A1 USE OF KINASE INHIBITORS IN PREVENTING AND TREATING INFLAMMATORY DISORDER NFKBIA, IRAK1, IRAK3 JAK2 184/4885ACVR1 2844/4885CAMK2D 38/4885

“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.

Send feedback