SCHEMBL2415997

SCHEMBL2415997

Cc1ccccc1C(=O)Nc1n[nH]c2sc(C(=O)NC(C)(C)C)cc12

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALPL P05186 1/20 0.40
THRB P10828 2/20 0.40
TP53 P04637 1/20 0.40
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
DHODH Q02127 1/20 0.39
HPGD P15428 2/20 0.39
ALDH1A1 P00352 3/20 0.38
TYK2 P29597 1/20 0.38
KCNJ11 Q14654 1/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 2/20 0.37
BDKRB1 P46663 1/20 0.37

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
SCHEMBL2418620 0.88 BDKRB1 (0.49) SMN1; SMN2NPSR1HPGDALDH1A1POLB
SCHEMBL2420153 0.88 NPC1 (0.42) SMN1; SMN2NPSR1TP53RAB9ANPC1
SCHEMBL2416143 0.87 NPC1 (0.43) SMN1; SMN2TP53RAB9ANPC1L3MBTL1
SCHEMBL1779328 0.86 RXFP1 (0.44) SMN1; SMN2NPSR1THRBTP53ALDH1A1
SCHEMBL2417780 0.86 MEN1 (0.46) SMN1; SMN2ALPLTHRBTP53HPGD
SCHEMBL2416444 0.86 HPGD (0.54) SMN1; SMN2THRBTP53RAB9ANPC1
SCHEMBL2421480 0.86 FGFR1 (0.45) SMN1; SMN2NPSR1RAB9ANPC1ALDH1A1
SCHEMBL2417516 0.85 CSNK2A2 (0.42) SMN1; SMN2ALPLTP53RAB9ANPC1
SCHEMBL2979430 0.85 TP53 (0.44) SMN1; SMN2ALPLTP53RAB9ANPC1
SCHEMBL2412972 0.84 SMN1; SMN2 (0.49) SMN1; SMN2THRBTP53RAB9ANPC1

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-7541378-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2009-06-02 US claimed
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 EP claimed
US-8017643-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-09-13 US disclosed
US-20100286223-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors PFIZER ITALIA S.R.L. (IT) 2010-11-11 US disclosed
US-7786048-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2010-08-31 US disclosed
US-20090233813-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors PFIZER ITALIA S.R.L. (IT) 2009-09-17 US disclosed
US-7541378-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2009-06-02 US disclosed
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 EP disclosed
US-20060122249-A1 Condensed heterocyclic pyrazole derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2006-06-08 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 (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-20100286223-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors CDK2, MAP3K19, MAP3K15 SMN1; SMN2 4291/4885NPSR1 4213/4885ALPL 3907/4885
US-20060122249-A1 Condensed heterocyclic pyrazole derivatives as kinase inhibitors CDK2, MAP3K19, MAP3K15 SMN1; SMN2 4291/4885NPSR1 4213/4885ALPL 3907/4885

“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.