SCHEMBL922182

SCHEMBL922182

NC1=NN=C(N2CCOCC2)C1=NNc1cccc(S(N)(=O)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.46
JAK3 P52333 1/20 0.46
CA1 P00915 10/20 0.45
CA2 P00918 10/20 0.45
SCN10A Q9Y5Y9 2/20 0.45
CDK2 P24941 2/20 0.44
CDK1 P06493 1/20 0.44
MTOR P42345 1/20 0.44
SMG1 Q96Q15 1/20 0.44
SRC P12931 1/20 0.44
CA12 O43570 7/20 0.41
CA9 Q16790 7/20 0.41
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
ALDH1A1 P00352 1/20 0.36
LRRK2 Q5S007 1/20 0.35
ROCK1 Q13464 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
SCHEMBL922181 1.00 JAK2 (0.46) JAK2JAK3CA1CA2SCN10A
SCHEMBL923170 0.90 CA2 (0.47) CA1CA2SCN10ACDK2CDK1
SCHEMBL923171 0.90 CA2 (0.47) CA1CA2SCN10ACDK2CDK1
SCHEMBL921974 0.89 TNNI3K (0.38) JAK2JAK3SCN10AALDH1A1
SCHEMBL921972 0.89 TNNI3K (0.38) JAK2JAK3SCN10AALDH1A1
SCHEMBL922558 0.85 EPHX2 (0.40) JAK2JAK3SCN10AMTORALDH1A1
SCHEMBL922556 0.85 EPHX2 (0.40) JAK2JAK3SCN10AMTORALDH1A1
SCHEMBL922209 0.83 DEPTOR (0.44) ALDH1A1LRRK2
SCHEMBL922208 0.83 DEPTOR (0.44) ALDH1A1LRRK2
SCHEMBL922465 0.82 ALDH1A1 (0.47) CA1CA2CA12CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140107125-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS DERMIRA (CANADA), INC. (US) 2014-04-17 US claimed
US-20110237783-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS Valocor Therapeutics, Inc. (CA) 2011-09-29 US claimed
US-20050272709-A1 Immugenic compositions and diagnostic and therapeutic uses thereof DERMIRA (CANADA), INC. 2005-12-08 US claimed
US-20140107125-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS DERMIRA (CANADA), INC. (US) 2014-04-17 US disclosed
US-8445694-B2 Hydrazonopyrazole derivatives and their use as therapeutics DERMIRA (CANADA), INC. (US) 2013-05-21 US disclosed
US-20110237783-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS Valocor Therapeutics, Inc. (CA) 2011-09-29 US disclosed
US-7875728-B2 tert-butyl-[5-methyl-4-(phenylhydrazono)-4H-pyrazol-3-yl]amine; 4-(3-fluorophenylhydrazono)-5-methyl-2H-pyrazol-3-ylamine; demonstrate anti-proliferative activity, and may promote apoptosis in cells lacking normal regulation of cell cycle and death Valocor Therapeutics, Inc. (CA) 2011-01-25 US disclosed
US-20050272709-A1 Immugenic compositions and diagnostic and therapeutic uses thereof DERMIRA (CANADA), INC. 2005-12-08 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 (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-20110237783-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS CDK4, CCNI, BCL2 JAK2 78/4885JAK3 146/4885CA1 4214/4885
US-20140107125-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS CDK4, CCNI, BCL2 JAK2 78/4885JAK3 146/4885CA1 4214/4885
US-20050272709-A1 Immugenic compositions and diagnostic and therapeutic uses thereof MKI67, CDK4, CCNC JAK2 252/4885JAK3 325/4885CA1 4303/4885

“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.