SCHEMBL2915847

SCHEMBL2915847

CN1CCN(c2ccc(C(=O)Nc3[nH]nc4c3CN(S(=O)(=O)c3ccccc3)C4)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 9/20 0.56
IGF1R P08069 1/20 0.55
AURKA O14965 10/20 0.54
KDR P35968 4/20 0.54
FLT1 P17948 3/20 0.54
ALDH1A1 P00352 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
AURKB Q96GD4 4/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
ABL1 P00519 1/20 0.48
BCR P11274 1/20 0.48
ALK Q9UM73 1/20 0.48
ACHE P22303 1/20 0.48

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
SCHEMBL2915850 0.84 IGF1R (0.70) FLT3IGF1RAURKAKDRFLT1
SCHEMBL2919885 0.84 STK25 (0.46) AURKAALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL2925281 0.80 AURKA (0.73) FLT3AURKAKDRFLT1AURKB
SCHEMBL2923174 0.80 KDM4E (0.53) IGF1RALDH1A1SMN1; SMN2
SCHEMBL2918892 0.80 AURKA (0.72) FLT3AURKAKDRFLT1AURKB
SCHEMBL2922374 0.79 STK25 (0.46) IGF1RAURKAALDH1A1SMN1; SMN2
SCHEMBL2921839 0.78 CCNA2 (0.47) AURKAALDH1A1SMN1; SMN2AURKBNPC1
SCHEMBL2923683 0.78 IGF1R (0.47) IGF1RALDH1A1SMN1; SMN2
SCHEMBL2915055 0.78 ALDH1A1 (0.49) AURKAALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL2924780 0.77 STK25 (0.46) IGF1RAURKAALDH1A1SMN1; SMN2

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 FLT3 437/4885IGF1R 1793/4885AURKA 347/4885
US-20090221632-A1 Bicyclo-Pyrazoles and Pharmaceutical Compositions Comprising Them MAP3K20, PLK2, PRKAA1 FLT3 605/4885IGF1R 2979/4885AURKA 600/4885
US-20030171357-A1 Bicyclo-pyrazoles active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K20, MAP3K19, MAP3K1 FLT3 437/4885IGF1R 1793/4885AURKA 347/4885

“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.