SCHEMBL2924232

SCHEMBL2924232

CS(=O)(=O)N1Cc2[nH]nc(NC(=O)CCC(=O)c3cccs3)c2C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.47
ALDH1A1 P00352 4/20 0.45
ESR1 P03372 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PARP1 P09874 1/20 0.43
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
KMT2A Q03164 7/20 0.42
MEN1 O00255 6/20 0.42
POLB P06746 4/20 0.42
MAPT P10636 1/20 0.42
GFER P55789 1/20 0.42
AURKA O14965 2/20 0.42
CCNA2 P20248 1/20 0.42
CDK2 P24941 1/20 0.42
CCNA1 P78396 1/20 0.42
GAA P10253 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL2922543 0.91 L3MBTL1 (0.50) L3MBTL1ALDH1A1PARP1RAB9ANPC1
SCHEMBL2916022 0.86 CCNA2 (0.45) L3MBTL1ALDH1A1PARP1KMT2AMEN1
SCHEMBL2922539 0.86 ALDH1A1 (0.48) ALDH1A1HTTSMN1; SMN2RAB9ANPC1
SCHEMBL2922280 0.85 AURKA (0.47) L3MBTL1ALDH1A1HTTSMN1; SMN2PARP1
SCHEMBL2920044 0.84 CCNA2 (0.60) L3MBTL1ALDH1A1PARP1RAB9ANPC1
SCHEMBL2923832 0.84 CCNA2 (0.49) SMN1; SMN2PARP1AURKACCNA2CDK2
SCHEMBL2924226 0.83 ALDH1A1 (0.46) L3MBTL1ALDH1A1ESR1HTTSMN1; SMN2
SCHEMBL2921030 0.83 AURKA (0.53) L3MBTL1ALDH1A1ESR1HTTSMN1; SMN2
SCHEMBL2924941 0.82 CCNA2 (0.60) L3MBTL1ALDH1A1PARP1RAB9ANPC1
SCHEMBL2918545 0.82 CCNA2 (0.50) L3MBTL1ALDH1A1PARP1RAB9ANPC1

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
EP-1320531-B1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PFIZER ITALIA SRL (IT) 2010-09-08 EP claimed
US-7541354-B2 Bicyclo-pyrazoles PFIZER ITALIA S.R.L. (IT) 2009-06-02 US claimed
US-20030171357-A1 Bicyclo-pyrazoles active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them NERVIANO MEDICAL SCIENCES S.R.L (IT) 2003-09-11 US claimed
US-8273765-B2 Bicyclo-pyrazoles and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2012-09-25 US disclosed
EP-1320531-B1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PFIZER ITALIA SRL (IT) 2010-09-08 EP disclosed
US-20090221632-A1 Bicyclo-Pyrazoles and Pharmaceutical Compositions Comprising Them PFIZER ITALIA S.R.L. (IT) 2009-09-03 US disclosed
US-7541354-B2 Bicyclo-pyrazoles PFIZER ITALIA S.R.L. (IT) 2009-06-02 US disclosed
US-7531531-B2 Method of treating diseases associated with altered kinase activity with bicyclo-pyrazoles PFIZER ITALIA S.R.L. (IT) 2009-05-12 US disclosed
US-20070191386-A1 Bicyclo-pyrazoles active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2007-08-16 US disclosed
US-20030171357-A1 Bicyclo-pyrazoles active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them NERVIANO MEDICAL SCIENCES S.R.L (IT) 2003-09-11 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 (3 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-20070191386-A1 Bicyclo-pyrazoles active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K20, MAP3K19, MAP3K1 L3MBTL1 3999/4885ALDH1A1 4090/4885ESR1 4031/4885
US-20090221632-A1 Bicyclo-Pyrazoles and Pharmaceutical Compositions Comprising Them MAP3K20, PLK2, PRKAA1 L3MBTL1 3671/4885ALDH1A1 3455/4885ESR1 3833/4885
US-20030171357-A1 Bicyclo-pyrazoles active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K20, MAP3K19, MAP3K1 L3MBTL1 3999/4885ALDH1A1 4090/4885ESR1 4031/4885

“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.