SCHEMBL1029331

SCHEMBL1029331

c1ccc2c(N3CCNCC3)ncnc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.67
HRH4 Q9H3N8 1/20 0.67
HTT P42858 2/20 0.64
LMNA P02545 3/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
CYP1A2 P05177 9/20 0.60
CYP3A4 P08684 9/20 0.60
CLK4 Q9HAZ1 6/20 0.60
CYP2C19 P33261 5/20 0.60
ALDH1A1 P00352 3/20 0.60
HRH1 P35367 1/20 0.58
HRH3 Q9Y5N1 1/20 0.58
HTR2C P28335 5/20 0.58
ADRB2 P07550 1/20 0.58
NCF1 P14598 1/20 0.58
KDM4E B2RXH2 3/20 0.56
HSD17B10 Q99714 3/20 0.56
USP2 O75604 3/20 0.56
MAPT P10636 2/20 0.56
HPGD P15428 2/20 0.56

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
SCHEMBL29936658 1.00 PTK2 (0.67) PTK2HRH4HTTLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL2797449 0.98 PTK2 (0.65) PTK2HRH4HTTLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL30059021 0.98 PTK2 (0.65) PTK2HRH4HTTLMNASMN1; SMN2
Hydrazine SCHEMBL2797134 0.97 PTK2 (0.63) PTK2HRH4HTTLMNASMN1; SMN2
SCHEMBL5235576 0.94 PTK2 (0.60) PTK2HRH4HTTLMNASMN1; SMN2
SCHEMBL11015775 0.84 PTK2 (0.73) PTK2HRH4HTTLMNASMN1; SMN2
SCHEMBL30821993 0.83 PTK2 (0.71) PTK2HRH4HTTLMNASMN1; SMN2
SCHEMBL6569122 0.83 PTK2 (0.71) PTK2HRH4HTTLMNASMN1; SMN2
SCHEMBL2203931 0.81 PTK2 (0.69) PTK2HRH4HTTLMNASMN1; SMN2
SCHEMBL29974523 0.81 PTK2 (0.56) PTK2HRH4HTTLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142506-B1 NOVEL BENZOPHENONE HYBRIDS AS POTENTIAL ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2013-10-16 EP claimed
US-8394954-B2 Benzophenone hybrids as anticancer agents and processes for the preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-03-12 US claimed
US-8309726-B2 Substituted piperazine compounds of formula 8 COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2012-11-13 US claimed
EP-2150527-B1 ANTHRANILIC ACID DERIVATIVE AS ANTICANCER AGENT AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2011-01-19 EP claimed
US-20100174074-A1 NOVEL BENZOPHENONE HYBRIDS AS POTENTIAL ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-07-08 US claimed
EP-2150527-A2 ANTHRANILIC ACID DERIVATIVE AS ANTICANCER AGENT AND A PROCESS FOR THE PREPARATION THEREOF Council of Scientific & Industrial Research (IN) 2010-02-10 EP claimed
US-20100016589-A1 Novel Anthranilic Acid Derivative as Potential Anticancer Agent and a Process for the Preparation Thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-01-21 US claimed
EP-2142506-A1 NOVEL BENZOPHENONE HYBRIDS AS POTENTIAL ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF Council of Scientific&Industrial Research (IN) 2010-01-13 EP claimed
WO-2008120235-A1 NOVEL BENZOPHENONE HYBRIDS AS POTENTIAL ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2008-10-09 WO claimed
WO-2008114275-A2 ANTHRANILIC ACID DERIVATIVES AS ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2008-09-25 WO claimed
US-12486255-B2 Modulators of RAS GTPase TOSK, INC. (US) 2025-12-02 US disclosed
US-20240279206-A1 Modulators of RAS GTPase TOSK, INC. 2024-08-22 US disclosed
US-11945803-B2 Modulators of RAS GTPase TOSK, INC. (US) 2024-04-02 US disclosed
US-20230127636-A1 COMPOUNDS FOR TREATING ILK-MEDIATED DISEASES THE CLEVELAND CLINIC FOUNDATION 2023-04-27 US disclosed
US-11524945-B2 Compounds for treating ILK-mediated diseases THE CLEVELAND CLINIC FOUNDATION (US) 2022-12-13 US disclosed
CN-88101642-A Piperazinyl-heterogeneous ring compound 1988-09-14 CN disclosed
EP-0000121-A1 6-(1-Piperazinyl)-quinoxaline, process for its preparation and pharmaceutical compositions thereof MERCK & CO. INC. (US) 1979-01-10 EP disclosed
US-4091098-A SEROTONINMIMETIC ACTIVITY; ANORECTIC, ANTIDEPRESSANT, ANALGESIC, HYPNOTIC AGENTS MERCK & CO., INC. (US) 1978-05-23 US disclosed
US-4091101-A ANORECTIC AGENTS MERCK & CO., INC. (US) 1978-05-23 US disclosed
US-4082845-A SEROTONINMIMETICS USEFUL AS ANORECTIC, ANTIDEPRESSANT, ANALGESIC AND HYPNOTIC AGENTS MERCK & CO., INC. (US) 1978-04-04 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 (7 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-20100174074-A1 NOVEL BENZOPHENONE HYBRIDS AS POTENTIAL ANTICANCER AGENTS AND A PROCESS FOR THE PREPARATION THEREOF TP53, RB1, MCL1 PTK2 2522/4885HRH4 3842/4885HTT 2010/4885
US-20230127636-A1 COMPOUNDS FOR TREATING ILK-MEDIATED DISEASES ILK, ITGB1, ITGA2B PTK2 11/4885HRH4 4423/4885HTT 3590/4885
US-12486255-B2 Modulators of RAS GTPase KRAS, HRAS, NRAS PTK2 1557/4885HRH4 2831/4885HTT 1434/4885
US-20100016589-A1 Novel Anthranilic Acid Derivative as Potential Anticancer Agent and a Process for the Preparation Thereof AADAC, API5, APEH PTK2 2494/4885HRH4 270/4885HTT 4496/4885
US-11945803-B2 Modulators of RAS GTPase KRAS, HRAS, NRAS PTK2 1557/4885HRH4 2831/4885HTT 1434/4885
US-20240279206-A1 Modulators of RAS GTPase KRAS, HRAS, NRAS PTK2 1557/4885HRH4 2831/4885HTT 1434/4885
US-11524945-B2 Compounds for treating ILK-mediated diseases ILK, ITGB1, ITGA2B PTK2 11/4885HRH4 4423/4885HTT 3590/4885

“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.