SCHEMBL922701

SCHEMBL922701

CCNC1=NN=C/C1=N\Nc1ccc2nnn(C)c2c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.36
GRM4 Q14833 1/20 0.35
NSD2 O96028 1/20 0.35
KDM4E B2RXH2 2/20 0.34
HSD17B10 Q99714 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
SLC9A1 P19634 1/20 0.32
KEAP1 Q14145 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL922310 0.75 MEN1 (0.32) HPGDMAPT
SCHEMBL922583 0.71 GRM4 (0.40) NOTUMGRM4NSD2KDM4EHSD17B10
SCHEMBL923056 0.68 CA2 (0.42) MAPTNPC1RAB9A
SCHEMBL923057 0.68 CA2 (0.42) MAPTNPC1RAB9A
SCHEMBL922478 0.68 RAB9A (0.37) KDM4EALDH1A1MAPTNPC1RAB9A
SCHEMBL922480 0.68 RAB9A (0.37) KDM4EALDH1A1MAPTNPC1RAB9A
SCHEMBL12890496 0.63 GRM4 (0.46) NOTUMGRM4NSD2KDM4EHSD17B10
SCHEMBL923903 0.61 RAB9A (0.45) NSD2KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL8828592 0.61 SLC9A1 (0.47) NOTUMGRM4NSD2KDM4EHSD17B10
SCHEMBL19330719 0.61 NSD2 (0.58) NOTUMNSD2KDM4EHSD17B10ALDH1A1

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 NOTUM 3514/4885GRM4 4508/4885NSD2 2422/4885
US-20140107125-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS CDK4, CCNI, BCL2 NOTUM 3514/4885GRM4 4508/4885NSD2 2422/4885
US-20050272709-A1 Immugenic compositions and diagnostic and therapeutic uses thereof MKI67, CDK4, CCNC NOTUM 3803/4885GRM4 4570/4885NSD2 3858/4885

“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.