SCHEMBL922653

SCHEMBL922653

Nc1ccc(O)c(CN2CCOCC2)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.73
CTSB P07858 1/20 0.59
CYP2C9 P11712 2/20 0.57
ALOX15 P16050 1/20 0.57
HSD17B10 Q99714 1/20 0.57
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
GAA P10253 2/20 0.49
POLB P06746 1/20 0.49
KDM4E B2RXH2 3/20 0.47
MAPT P10636 3/20 0.47
CYP2A13 Q16696 5/20 0.46
TSHR P16473 1/20 0.46
GFER P55789 1/20 0.46
BACE1 P56817 1/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL126246 0.88 ACHE (0.86) ACHECTSBALOX15POLBKDM4E
SCHEMBL29565193 0.88 ACHE (0.86) ACHECTSBALOX15POLBKDM4E
SCHEMBL2013061 0.87 CYP2C9 (0.62) ACHECTSBCYP2C9ALOX15HSD17B10
Hydrochloric Acid SCHEMBL5694431 0.86 ACHE (0.87) ACHECTSBALOX15POLBKDM4E
SCHEMBL28837434 0.85 ACHE (1.00) ACHEGAAKDM4ETSHRGFER
SCHEMBL8800403 0.83 CTSB (0.62) ACHECTSBCYP2C9ALOX15HSD17B10
SCHEMBL6268368 0.83 CYP2C9 (0.51) ACHECTSBCYP2C9ALOX15HSD17B10
SCHEMBL2513902 0.83 CTSB (0.58) ACHECTSBCYP2C9ALOX15HSD17B10
SCHEMBL2513906 0.83 CTSB (0.58) ACHECTSBCYP2C9ALOX15HSD17B10
SCHEMBL13338342 0.83 CTSB (0.58) ACHECTSBCYP2C9ALOX15HSD17B10

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 10 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-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
CN-1671379-A Hydrazinopyrazole derivatives and their use as therapeutic agents QUADRA LOGIC TECH INC (CA) 2005-09-21 CN 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 (4 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 ACHE 4763/4885CTSB 2352/4885CYP2C9 2865/4885
US-20140107125-A1 HYDRAZONOPYRAZOLE DERIVATIVES AND THEIR USE AS THERAPEUTICS CDK4, CCNI, BCL2 ACHE 4763/4885CTSB 2352/4885CYP2C9 2865/4885
US-20050272709-A1 Immugenic compositions and diagnostic and therapeutic uses thereof MKI67, CDK4, CCNC ACHE 4350/4885CTSB 1742/4885CYP2C9 4568/4885
US-20030060453-A1 Pyrazole compounds CCNC, MKI67, CDC25C ACHE 4778/4885CTSB 2453/4885CYP2C9 2468/4885

“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.