SCHEMBL924103

SCHEMBL924103

CONc1cccc([N+](=O)[O-])c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.63
KMT2A Q03164 7/20 0.62
MEN1 O00255 6/20 0.62
MAPT P10636 6/20 0.62
POLB P06746 3/20 0.62
HTT P42858 2/20 0.62
DDX3X O00571 1/20 0.62
CTDSP1 Q9GZU7 1/20 0.62
ALDH1A1 P00352 5/20 0.58
MAPK1 P28482 2/20 0.58
HPGD P15428 2/20 0.58
HSP90AA1 P07900 1/20 0.58
CACNA1B Q00975 1/20 0.58
APBA1 Q02410 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
NLRP1 Q9C000 1/20 0.58
BLM P54132 1/20 0.55
LMNA P02545 1/20 0.55
TSHR P16473 1/20 0.55
ALOX12 P18054 2/20 0.55

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
SCHEMBL14155070 0.84 KMT2A (0.51) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL5892586 0.81 SMN1; SMN2 (0.71) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL28177397 0.81 ALDH1A1 (0.55) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL28009280 0.80 SMN1; SMN2 (0.56) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL732435 0.79 SMN1; SMN2 (0.64) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL11445187 0.79 MAPT (0.68) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL584567 0.79 ALDH1A1 (0.52) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL9655921 0.79 KMT2A (0.54) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL14414997 0.79 SMN1; SMN2 (0.51) SMN1; SMN2KMT2AMEN1MAPTPOLB
SCHEMBL11179084 0.79 MEN1 (0.58) SMN1; SMN2KMT2AMEN1MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022234965-A1 HETEROARYL DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT 주식회사 보로노이 2022-11-10 WO disclosed
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
EP-2327677-A1 Mono-nitration of aromatic compounds F. Hoffmann-La Roche AG (CH) 2011-06-01 EP 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
EP-2016034-A2 MONO-NITRATION OF AROMATIC COMPOUNDS F. Hoffmann-Roche AG (CH) 2009-01-21 EP disclosed
US-7429589-B2 Mono-nitration of aromatic compounds via nitrate salts HOFFMANN-LA ROCHE INC. (US) 2008-09-30 US disclosed
WO-2007125034-A2 MONO-NITRATION OF AROMATIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2007-11-08 WO disclosed
US-20070255057-A1 Mono-nitration of aromatic compounds via nitrate salts CEDILOTE MIALL 2007-11-01 US disclosed
US-7105503-B2 Pyrazole compounds QLT INC. (CA) 2006-09-12 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
US-20030060453-A1 Pyrazole compounds DERMIRA (CANADA), INC. 2003-03-27 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 (5 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 SMN1; SMN2 4161/4885KMT2A 2931/4885MEN1 3936/4885
US-20140107125-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS CDK4, CCNI, BCL2 SMN1; SMN2 4161/4885KMT2A 2931/4885MEN1 3936/4885
US-20050272709-A1 Immugenic compositions and diagnostic and therapeutic uses thereof MKI67, CDK4, CCNC SMN1; SMN2 2243/4885KMT2A 4148/4885MEN1 1844/4885
US-20030060453-A1 Pyrazole compounds CCNC, MKI67, CDC25C SMN1; SMN2 3557/4885KMT2A 3543/4885MEN1 3439/4885
US-20070255057-A1 Mono-nitration of aromatic compounds via nitrate salts NOS2, NOS3, NOS1 SMN1; SMN2 3204/4885KMT2A 2556/4885MEN1 2021/4885

“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.