SCHEMBL740536

SCHEMBL740536

CN1CCN(c2ccc(C(=O)Nc3nn(C(=O)c4ccc(N5CCN(C)CC5)cc4)c4sc(C(=O)OC(C)(C)C)cc34)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AURKA O14965 9/20 0.46
ABL1 P00519 1/20 0.44
BCR P11274 1/20 0.44
KIT P10721 2/20 0.44
FLT3 P36888 2/20 0.44
NTRK1 P04629 1/20 0.43
PDE7A Q13946 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
FGFR1 P11362 1/20 0.41
KDR P35968 1/20 0.41

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
SCHEMBL5981101 0.97 AURKA (0.44) AURKAABL1BCRKITFLT3
SCHEMBL741671 0.90 AURKA (0.46) AURKAABL1BCRKITFLT3
SCHEMBL739309 0.81 CSNK1D (0.45) PDE7ANPC1RAB9A
SCHEMBL740704 0.80 AURKA (0.56) AURKAABL1BCRKITFLT3
SCHEMBL740739 0.78 IKBKE (0.42) ABL1BCRKITFLT3RAB9A
Hydrochloric Acid SCHEMBL741106 0.78 AURKA (0.47) AURKAKITFLT3PDE7ANPC1
SCHEMBL1777894 0.78 ALK (0.43) AURKANTRK1PDE7ANPC1RAB9A
Hydrochloric Acid SCHEMBL5981340 0.78 CSNK1D (0.42) AURKAPDE7ANPC1RAB9A
SCHEMBL3891657 0.78 AURKA (0.53) AURKANPC1RAB9A
SCHEMBL1781045 0.76 SIRT6 (0.42) PDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481584-B2 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-07-09 US disclosed
US-20120165311-A1 1H-THIENO[2,3-C]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-06-28 US disclosed
US-8138217-B2 Aurora kinase inhibitors; proliferative disorders; anticancer agents; antitumor agents; N-(1-methyl-1-phenylethyl)-3-((4-morpholin-4-ylbenzoyl)amino)-1H-thieno(2,3-c)pyrazole-5-carboxamide NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-03-20 US disclosed
EP-1711177-B1 1H-THIENO 2,3-c PYRAZOLE DERIVATIVES USEFUL AS KINASE I INHIBITORS PFIZER ITALIA SRL (IT) 2008-05-28 EP disclosed
CN-1946395-A 1H-thieno [2, 3-c ] pyrazole derivatives useful as kinase inhibitors PHARMACIA ITALIA SPA (IT) 2007-04-11 CN disclosed
US-20050187209-A1 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors PHARMACIA ITALIA S.P.A. (IT) 2005-08-25 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 (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-20120165311-A1 1H-THIENO[2,3-C]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS MAP3K19, MAP3K1, MAP3K3 AURKA 349/4885ABL1 151/4885BCR 942/4885
US-20050187209-A1 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors MAP3K19, MAP3K1, MAP3K3 AURKA 340/4885ABL1 149/4885BCR 907/4885

“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.