SCHEMBL742843

SCHEMBL742843

CCOC(=O)n1nc(NC(=O)c2ccc(F)cc2)c2cc(C(=O)O)sc21

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.47
P2RY14 Q15391 5/20 0.45
ADORA2A P29274 4/20 0.42
ADORA3 P0DMS8 3/20 0.42
ADORA1 P30542 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
MAPT P10636 1/20 0.42
CNR2 P34972 1/20 0.42
BRAF P15056 1/20 0.42
KDM4E B2RXH2 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TP53 P04637 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL742441 0.89 ADORA2A (0.46) LMNAADORA2AADORA3ADORA1ALDH1A1
SCHEMBL741290 0.88 P2RY14 (0.40) P2RY14ALDH1A1HPGDMAPTKDM4E
SCHEMBL740940 0.86 ALDH1A1 (0.44) LMNAADORA2AADORA3ADORA1ALDH1A1
SCHEMBL4632612 0.86 ADORA2A (0.41) LMNAADORA2AADORA3ADORA1ALDH1A1
SCHEMBL4633164 0.86 ABL1 (0.44) LMNAADORA2AADORA3ADORA1ALDH1A1
SCHEMBL742629 0.85 AURKA (0.46) LMNAADORA2AADORA3ADORA1BRAF
SCHEMBL741756 0.84 BRAF (0.39) LMNAADORA2AADORA3ADORA1ALDH1A1
Hydrochloric Acid SCHEMBL740981 0.84 LRRK2 (0.46) LMNAHPGDMAPTKDM4ETP53
Hydrochloric Acid SCHEMBL741106 0.84 AURKA (0.47) KMT2A
SCHEMBL740605 0.83 BRAF (0.38) LMNAADORA2AADORA3ADORA1ALDH1A1

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 7 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
EP-1711177-A1 1H-THIENO 2,3-c PYRAZOLE DERIVATIVES USEFUL AS KINASE I INHIBITORS Pfizer Italia S.r.l. (IT) 2006-10-18 EP 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
WO-2005074922-A1 1H-THIENO[2,3-c]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS PFIZER ITALIA S.R.L. (IT) 2005-08-18 WO 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 LMNA 3383/4885P2RY14 1007/4885ADORA2A 2399/4885
US-20050187209-A1 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors MAP3K19, MAP3K1, MAP3K3 LMNA 3398/4885P2RY14 1037/4885ADORA2A 2466/4885

“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.