SCHEMBL5017

SCHEMBL5017

c1ccc(-c2nn[nH]n2)cc1

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.78
GP6 Q9HCN6 1/20 0.74
ADH5 P11766 1/20 0.74
ALDH1A1 P00352 2/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
RPA1 P27694 1/20 0.63
ATM Q13315 1/20 0.63
CYP2A6 P11509 1/20 0.62
IDO1 P14902 1/20 0.60
PTGS2 P35354 1/20 0.58
XDH P47989 6/20 0.57
TP53 P04637 2/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
PBRM1 Q86U86 1/20 0.53

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
Hydrochloric Acid SCHEMBL30810801 0.98 HPGDS (0.75) HPGDSGP6ADH5ALDH1A1MEN1
SCHEMBL4983079 0.98 HPGDS (0.75) HPGDSGP6ADH5ALDH1A1MEN1
SCHEMBL2839742 0.88 HPGDS (1.00) HPGDSGP6ADH5ALDH1A1MEN1
SCHEMBL9984638 0.87 ADH5 (0.95) HPGDSGP6ADH5ALDH1A1MEN1
SCHEMBL25378122 0.86 GP6 (1.00) HPGDSGP6ADH5ALDH1A1MEN1
SCHEMBL30153550 0.83 MEN1 (0.80) HPGDSGP6ADH5ALDH1A1MEN1
SCHEMBL8783081 0.83 MEN1 (0.80) HPGDSGP6ADH5ALDH1A1MEN1
SCHEMBL16859786 0.82 ADH5 (0.62) HPGDSGP6ADH5ALDH1A1MEN1
SCHEMBL1250336 0.82 ADH5 (0.61) HPGDSGP6ADH5RPA1ATM
SCHEMBL2932335 0.79 ADH5 (0.71) HPGDSGP6ADH5ALDH1A1MEN1

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 215 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118610578-A Application of azole-rich compound in lithium ion battery electrolyte, lithium ion battery electrolyte and preparation method of lithium ion battery electrolyte 仲恺农业工程学院 2024-09-06 CN claimed
US-20150150893-A1 ANDROGRAPHOLIDE ANALOGS AND THEIR USE FOR MEDICATION LIAONING LIFENG SCIENT & TECHNOLOGY DEV COMPANY LTD (CN) 2015-06-04 US claimed
EP-2508555-B1 Process for producing pre-expandable plastic beads and beads obtainable according to said process ELECTROLUX HOME PROD CORP (BE) 2015-05-13 EP claimed
EP-2508555-A1 Process for producing pre-expandable plastic beads and beads obtainable according to said process Electrolux Home Products Corporation N.V. (BE) 2012-10-10 EP claimed
EP-1641792-B1 PYRROLODIHYDROISOQUINOLINES AS PDE10 INHIBITORS NYCOMED GMBH (DE) 2010-08-25 EP claimed
US-7569580-B2 Tetrazolo[1,5-a]thieno[2,3-e]pyridine-4-carboxylic acid RIGEL PHARMACEUTICALS, INC. (US) 2009-08-04 US claimed
CN-1070193-C Process for preparing 1-butyl-2-[2'-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-1H-indole-3-carboxylic acid SYNTEX INC (US) 2001-08-29 CN claimed
CN-1149293-A Process for preparing 1-butyl-2-[2'-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-1H-indole-3-carboxylic acid SYNTEX INC (US) 1997-05-07 CN claimed
EP-0760815-A1 PROCESSES FOR PREPARING 1-BUTYL-2-[2'-(2H-TETRAZOL-5-YL)-BIPHENYL-4-YLMETHYL]-1H-INDOLE-3-CARBOXYLIC ACID SYNTEX (U.S.A.) INC. (US) 1997-03-12 EP claimed
WO-1995032962-A1 PROCESSES FOR PREPARING 1-BUTYL-2-[2'-(2H-TETRAZOL-5-YL)-BIPHENYL-4-YLMETHYL]-1H-INDOLE-3-CARBOXYLIC ACID SYNTEX (U.S.A.) INC. (US) 1995-12-07 WO claimed
US-5412102-A Processes for preparing 1-butyl-2-[2'-(2H-tetrazol-5-yl) biphenyl-4-ylmethyl]-1H-indole-3-carboxylic acid SYNTEX (U.S.A.) INC. (US) 1995-05-02 US claimed
US-12565492-B2 Anaplastic Lymphoma Kinase (ALK) degraders and uses thereof TRIANA BIOMEDICINES, INC. (US) 2026-03-03 US disclosed
US-20260042752-A1 ANAPLASTIC LYMPHOMA KINASE (ALK) DEGRADERS AND USES THEREOF TRIANA BIOMEDICINES INC (US) 2026-02-12 US disclosed
WO-2025236011-A1 COMPOSITIONS FOR PHOSPHOROUS-AZOLE EXCHANGE CHEMISTRY AND USE THEREOF TO TARGET FUNCTIONAL PROTEIN SITES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-11-13 WO disclosed
EP-4605247-A1 ELASTOMERIC COMPOSITIONS FOR TYRES COMPRISING NNEEWW CROSS-LINKING FUNCTIONALISING AGENTS, ELASTOMERIC COMPOUNDS AND TYRES COMPRISING THEM Pirelli Tyre S.p.A. (IT) 2025-08-27 EP disclosed
US-5412102-A Processes for preparing 1-butyl-2-[2'-(2H-tetrazol-5-yl) biphenyl-4-ylmethyl]-1H-indole-3-carboxylic acid SYNTEX (U.S.A.) INC. (US) 1995-05-02 US disclosed
US-RE34201-E Analgesics ANAQUEST, INC. (US) 1993-03-23 US disclosed
US-5053411-A Analgesics ANAQUEST, INC. (US) 1991-10-01 US disclosed
EP-0396282-A2 N-aryl-N-[4-(heterocyclicalkyl) piperidinyl]amides and pharmaceutical compositions and methods employing such compounds BOC, INC. (US) 1990-11-07 EP disclosed
US-3959301-A HERBICIDE GULF RESEARCH & DEVELOPMENT COMPANY (US) 1976-05-25 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-20260042752-A1 ANAPLASTIC LYMPHOMA KINASE (ALK) DEGRADERS AND USES THEREOF ALK, NTRK1, NTRK3 HPGDS 4764/4885GP6 1908/4885ADH5 1955/4885
US-20150150893-A1 ANDROGRAPHOLIDE ANALOGS AND THEIR USE FOR MEDICATION CYP11B1, CYP51A1, CYP11B2 HPGDS 184/4885GP6 339/4885ADH5 1440/4885
US-12565492-B2 Anaplastic Lymphoma Kinase (ALK) degraders and uses thereof ALK, NTRK3, NTRK1 HPGDS 4302/4885GP6 1952/4885ADH5 1594/4885

“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.