SCHEMBL643387

SCHEMBL643387

NCC1CCCc2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.56
RET P07949 1/20 0.55
HTR2A P28223 1/20 0.55
IDO1 P14902 2/20 0.53
CYP19A1 P11511 1/20 0.49
TBXAS1 P24557 1/20 0.49

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 SCHEMBL27196405 0.98 HTR6 (0.55) HTR6RETHTR2AIDO1CYP19A1
SCHEMBL428148 0.94 HTR2A (0.53) HTR6RETHTR2AIDO1
Oxalic Acid SCHEMBL5361082 0.90 HTR6 (0.56) HTR6RETHTR2A
SCHEMBL62360 0.88 HTR6 (0.59) HTR6RETHTR2AIDO1
SCHEMBL61507 0.88 HTR6 (0.59) HTR6RETHTR2AIDO1
SCHEMBL29681415 0.88 HTR6 (0.59) HTR6RETHTR2AIDO1
SCHEMBL18440732 0.87 CYP19A1 (0.55) RETHTR2AIDO1CYP19A1TBXAS1
Hydrochloric Acid SCHEMBL15818880 0.86 HTR6 (0.57) HTR6RETHTR2AIDO1
SCHEMBL7898127 0.84 IDO1 (0.52) HTR6IDO1CYP19A1TBXAS1
SCHEMBL598590 0.81 CYP19A1 (0.49) IDO1CYP19A1TBXAS1

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-0443588-B1 Condensed thiazole compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-06-23 EP claimed
EP-0352613-B1 Substituted amino methyl tetralines, and their heterocyclic analogous compounds BAYER AG (DE) 1994-04-20 EP claimed
EP-0352613-A2 Substituted amino methyl tetralines, and their heterocyclic analogous compounds BAYER AG (DE) 1990-01-31 EP claimed
US-20230286917-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2023-09-14 US disclosed
US-11639333-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC (US) 2023-05-02 US disclosed
US-11214542-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2022-01-04 US disclosed
US-20210009520-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2021-01-14 US disclosed
US-10807956-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2020-10-20 US disclosed
US-20200172485-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2020-06-04 US disclosed
US-10597365-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2020-03-24 US disclosed
US-20190077758-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2019-03-14 US disclosed
EP-0395734-A1 1-AMINOMETHYL-1,2,3,4-TETRAHYDRONAPHTHALENES ABBOTT LABORATORIES (US) 1990-11-07 EP disclosed
EP-0395734-A1 1-AMINOMETHYL-1,2,3,4-TETRAHYDRONAPHTHALENES ABBOTT LABORATORIES (US) 1990-11-07 EP disclosed
EP-0352613-A2 Substituted amino methyl tetralines, and their heterocyclic analogous compounds BAYER AG (DE) 1990-01-31 EP disclosed
EP-0352613-A2 Substituted amino methyl tetralines, and their heterocyclic analogous compounds BAYER AG (DE) 1990-01-31 EP disclosed
EP-0352613-A2 Substituted amino methyl tetralines, and their heterocyclic analogous compounds BAYER AG (DE) 1990-01-31 EP disclosed
EP-0325963-A1 1-Aminomethyl-1,2,3,4-tetrahydronaphthalenes and -indanes ABBOTT LABORATORIES (US) 1989-08-02 EP disclosed
EP-0325963-A1 1-Aminomethyl-1,2,3,4-tetrahydronaphthalenes and -indanes ABBOTT LABORATORIES (US) 1989-08-02 EP disclosed
WO-1989006645-A1 1-AMINOMETHYL-1,2,3,4-TETRAHYDRONAPHTHALENES ABBOTT LABORATORIES (US) 1989-07-27 WO disclosed
WO-1989006645-A1 1-AMINOMETHYL-1,2,3,4-TETRAHYDRONAPHTHALENES ABBOTT LABORATORIES (US) 1989-07-27 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 (8 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-20190077758-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A HTR6 2395/4885RET 1186/4885HTR2A 2975/4885
US-11214542-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A HTR6 2395/4885RET 1186/4885HTR2A 2975/4885
US-10807956-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A HTR6 2395/4885RET 1186/4885HTR2A 2975/4885
US-20230286917-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A HTR6 2395/4885RET 1186/4885HTR2A 2975/4885
US-20210009520-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A HTR6 2395/4885RET 1186/4885HTR2A 2975/4885
US-11639333-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A HTR6 2395/4885RET 1186/4885HTR2A 2975/4885
US-20200172485-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A HTR6 2395/4885RET 1186/4885HTR2A 2975/4885
US-10597365-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM1A HTR6 2395/4885RET 1186/4885HTR2A 2975/4885

“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.