SCHEMBL2925528

SCHEMBL2925528

CC(C)NC(=O)NN1Cc2n[nH]c(NC(=O)c3ccc(C(C)(C)C)cc3)c2C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 2/20 0.39
AURKA O14965 5/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
ALPL P05186 1/20 0.38
KMT2A Q03164 2/20 0.38
F2 P00734 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
TRPV4 Q9HBA0 1/20 0.36
GRIN2C Q14957 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
MITF O75030 1/20 0.36
MAPT P10636 1/20 0.36
KLF5 Q13887 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
PARP1 P09874 1/20 0.35
RECQL P46063 1/20 0.35
NR1H4 Q96RI1 1/20 0.35

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
SCHEMBL2915964 0.91 SMN1; SMN2 (0.39) SMN1; SMN2TP53AURKANPC1RAB9A
SCHEMBL2919780 0.91 SMN1; SMN2 (0.39) SMN1; SMN2TP53AURKANPC1RAB9A
SCHEMBL2916446 0.86 AURKA (0.41) SMN1; SMN2TP53AURKANPC1RAB9A
SCHEMBL2919570 0.85 KCNK9 (0.44) AURKANPC1RAB9APARP1NR1H4
SCHEMBL2924508 0.85 ALDH1A1 (0.41) SMN1; SMN2TP53NPC1RAB9AKMT2A
SCHEMBL2923869 0.85 EPHX1 (0.47) SMN1; SMN2TP53AURKANPC1RAB9A
SCHEMBL2920027 0.83 SMN1; SMN2 (0.42) SMN1; SMN2TP53AURKANPC1RAB9A
SCHEMBL2916745 0.82 RAB9A (0.46) SMN1; SMN2TP53NPC1RAB9AKMT2A
SCHEMBL2925532 0.82 AURKA (0.55) AURKA
SCHEMBL2922807 0.82 AURKA (0.54) SMN1; SMN2TP53AURKANPC1RAB9A

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 SMN1; SMN2 3514/4885TP53 779/4885AURKA 347/4885
US-20090221632-A1 Bicyclo-Pyrazoles and Pharmaceutical Compositions Comprising Them MAP3K20, PLK2, PRKAA1 SMN1; SMN2 2568/4885TP53 577/4885AURKA 600/4885
US-20030171357-A1 Bicyclo-pyrazoles active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K20, MAP3K19, MAP3K1 SMN1; SMN2 3514/4885TP53 779/4885AURKA 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.