SCHEMBL922537

SCHEMBL922537

NC1=NN=C(c2ccncc2)/C1=N\Nc1cccc(S(N)(=O)=O)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRK2 P25098 2/20 0.43
ROCK2 O75116 1/20 0.43
GRK3 P35626 1/20 0.43
ROCK1 Q13464 1/20 0.40
ALPL P05186 1/20 0.40
ALPI P09923 1/20 0.40
CA2 P00918 7/20 0.39
CA1 P00915 6/20 0.39
KMT2A Q03164 2/20 0.38
LRRK2 Q5S007 2/20 0.37
CA12 O43570 3/20 0.37
CA9 Q16790 3/20 0.37
MAPT P10636 1/20 0.37
ATR Q13535 1/20 0.37
BRAF P15056 1/20 0.36
TNNI3K Q59H18 1/20 0.36

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
SCHEMBL922538 1.00 GRK2 (0.43) GRK2ROCK2GRK3ROCK1ALPL
SCHEMBL922301 0.86 KMT2A (0.52) GRK2ROCK2CA2CA1KMT2A
SCHEMBL922300 0.86 KMT2A (0.52) GRK2ROCK2CA2CA1KMT2A
SCHEMBL922011 0.85 CA2 (0.48) ROCK1CA2CA1CA12CA9
SCHEMBL923684 0.85 ALDH1A1 (0.38) GRK2ROCK2GRK3ALPLALPI
SCHEMBL923681 0.85 ALDH1A1 (0.38) GRK2ROCK2GRK3ALPLALPI
SCHEMBL922439 0.81 DEPTOR (0.48) GRK2ROCK2GRK3KMT2AMAPT
SCHEMBL922438 0.81 DEPTOR (0.48) GRK2ROCK2GRK3KMT2AMAPT
SCHEMBL922303 0.80 DEPTOR (0.40) KMT2AMAPTATR
SCHEMBL922304 0.80 DEPTOR (0.40) KMT2AMAPTATR

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 5 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 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 GRK2 1920/4885ROCK2 1599/4885GRK3 776/4885
US-20140107125-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS CDK4, CCNI, BCL2 GRK2 1920/4885ROCK2 1599/4885GRK3 776/4885
US-20050272709-A1 Immugenic compositions and diagnostic and therapeutic uses thereof MKI67, CDK4, CCNC GRK2 2801/4885ROCK2 1588/4885GRK3 2133/4885

“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.