SCHEMBL922388

SCHEMBL922388

NC1=NN=C(CCCCN2CCOCC2)/C1=N\Nc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
SIGMAR1 Q99720 1/20 0.43
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
PARP1 P09874 2/20 0.41
LMNA P02545 4/20 0.41
KDM4E B2RXH2 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
GAA P10253 2/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
GLA P06280 1/20 0.41
RAD52 P43351 1/20 0.41
MAPT P10636 2/20 0.40
MAPK1 P28482 2/20 0.40
CYP2C19 P33261 1/20 0.39
EPHX2 P34913 3/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
HTT P42858 2/20 0.38

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
SCHEMBL922389 1.00 POLB (0.43) POLBSIGMAR1KMT2AMEN1PARP1
SCHEMBL921676 0.92 KMT2A (0.41) POLBSIGMAR1KMT2AMEN1LMNA
SCHEMBL921678 0.92 KMT2A (0.41) POLBSIGMAR1KMT2AMEN1LMNA
SCHEMBL922320 0.85 CYP3A4 (0.47) POLBSIGMAR1KMT2AMEN1MAPK1
SCHEMBL922318 0.85 CYP3A4 (0.47) POLBSIGMAR1KMT2AMEN1MAPK1
SCHEMBL924587 0.77 DEPTOR (0.39) KMT2AMEN1GAARAB9ANPC1
SCHEMBL924586 0.77 DEPTOR (0.39) KMT2AMEN1GAARAB9ANPC1
SCHEMBL923767 0.77 SIGMAR1 (0.44) POLBSIGMAR1EPHX2
SCHEMBL922465 0.74 ALDH1A1 (0.47) POLBLMNAKDM4ENPSR1GAA
SCHEMBL922466 0.74 ALDH1A1 (0.47) POLBLMNAKDM4ENPSR1GAA

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 11 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-20050272709-A1 Immugenic compositions and diagnostic and therapeutic uses thereof DERMIRA (CANADA), INC. 2005-12-08 US claimed
EP-1450791-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS Kinetek Pharmaceuticals, Inc. (CA) 2004-09-01 EP claimed
WO-2003045379-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS KINETEK PHARMACEUTICALS, INC. (CA) 2003-06-05 WO 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
EP-1450791-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS Kinetek Pharmaceuticals, Inc. (CA) 2004-09-01 EP disclosed
WO-2003045379-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS KINETEK PHARMACEUTICALS, INC. (CA) 2003-06-05 WO 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 POLB 1521/4885SIGMAR1 4017/4885KMT2A 2931/4885
US-20140107125-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS CDK4, CCNI, BCL2 POLB 1521/4885SIGMAR1 4017/4885KMT2A 2931/4885
US-20050272709-A1 Immugenic compositions and diagnostic and therapeutic uses thereof MKI67, CDK4, CCNC POLB 1409/4885SIGMAR1 4165/4885KMT2A 4148/4885

“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.