SCHEMBL1979683

SCHEMBL1979683

O=S(=O)(Nc1cccc(-c2n[nH]cc2-c2ccncc2)c1)c1csc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.43
MAPT P10636 2/20 0.42
PFKFB3 Q16875 1/20 0.41
IMPDH2 P12268 2/20 0.41
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
HTR6 P50406 1/20 0.40
PDPK1 O15530 1/20 0.40
FABP4 P15090 1/20 0.38
FABP5 Q01469 1/20 0.38
BRD4 O60885 1/20 0.37
MAP2K7 O14733 1/20 0.37
MAP2K4 P45985 1/20 0.37
CCR1 P32246 1/20 0.37
CCR2 P41597 1/20 0.37
CCR4 P51679 1/20 0.37
TTK P33981 1/20 0.36
HTT P42858 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL1849230 0.82 PIK3CA (0.50) IMPDH2FABP4FABP5BRD4MAP2K7
SCHEMBL1847979 0.82 ALDH1A1 (0.49) MAPTIMPDH2BRD4MEN1KMT2A
SCHEMBL1977467 0.82 BRD4 (0.54) MAPTBRD4TTKHTTMEN1
SCHEMBL1850691 0.81 IMPDH2 (0.57) PFKFB3IMPDH2MAP2K7MAP2K4HTT
SCHEMBL1851690 0.80 BRD4 (0.49) BRD4HTTLMNA
SCHEMBL1848152 0.79 L3MBTL1 (0.48) PFKFB3FABP4FABP5MAP2K7MAP2K4
SCHEMBL1847482 0.79 IMPDH2 (0.45) PFKFB3IMPDH2BRD4MAP2K7MAP2K4
SCHEMBL1847582 0.79 CYP1A2 (0.47) BRD4HTTALDH1A1LMNANTRK1
SCHEMBL4546719 0.78 IMPDH2 (0.47) PFKFB3IMPDH2MAP2K7MAP2K4HTT
SCHEMBL1847710 0.78 CYP19A1 (0.56) PFKFB3IMPDH2BRD4MAP2K4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946250-B2 3,4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-02-03 US disclosed
US-8946250-B2 3,4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-02-03 US disclosed
US-8541575-B2 3,4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-09-24 US disclosed
US-8541575-B2 3,4-diarylpyrazoles as protein kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-09-24 US disclosed
EP-2324008-B1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2012-05-09 EP disclosed
US-20110144068-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-06-16 US disclosed
US-20110144068-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-06-16 US disclosed
US-20110144068-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-06-16 US disclosed
WO-2010010154-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-01-28 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 (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-20110144068-A1 3,4-DIARYLPYRAZOLES AS PROTEIN KINASE INHIBITORS MAP3K3, MAP3K19, MAP3K15 HTR2C 3748/4885MAPT 3183/4885PFKFB3 600/4885

“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.