SCHEMBL16033376

SCHEMBL16033376

Fc1cccc2c1CCC2Br

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 8/20 0.44
▸ DRD3 P35462 8/20 0.44
▸ CHRNB2 P17787 1/20 0.37
▸ CHRNA7 P36544 1/20 0.37
▸ CHRNA4 P43681 1/20 0.37
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ IDO1 P14902 1/20 0.36
▸ KDM4A O75164 1/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ KDM1A O60341 2/20 0.34
▸ KDM1B Q8NB78 1/20 0.34
▸ HTR1A P08908 2/20 0.33
▸ HTR7 P34969 2/20 0.33

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
SCHEMBL16466650 0.78 DRD2 (0.46) DRD2DRD3CHRNB2CHRNA7CHRNA4
SCHEMBL30340560 0.78 GID4 (0.46) DRD2KDM1A
SCHEMBL21616753 0.78 GID4 (0.46) DRD2KDM1A
SCHEMBL4666253 0.76 DRD2 (0.53) DRD2DRD3CHRNB2CHRNA7CHRNA4
SCHEMBL22143868 0.76 DRD2 (0.44) DRD2DRD3CHRNB2CHRNA7CHRNA4
SCHEMBL1154471 0.76 DRD2 (0.44) DRD2DRD3CHRNB2CHRNA7CHRNA4
SCHEMBL1150855 0.76 DRD2 (0.53) DRD2DRD3CHRNB2CHRNA7CHRNA4
SCHEMBL17702023 0.76 DRD2 (0.53) DRD2DRD3CHRNB2CHRNA7CHRNA4
SCHEMBL18204509 0.76 HTR2C (0.45) TRPM8IDO1KDM1AHTR1AHTR7
SCHEMBL30327617 0.76 DRD2 (0.53) DRD2DRD3CHRNB2CHRNA7CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969007-B1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2019-05-08 — — EP disclosed
US-10273222-B2 Histone demethylase inhibitors CELGENE QUANTSCEL RESEARCH, INC. (US) 2019-04-30 — — US disclosed
US-9963441-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-05-08 — — US disclosed
US-20170334879-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2017-11-23 — — US disclosed
US-9701657-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2017-07-11 — — US disclosed
US-20170066739-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE PHARMACEUTICALS INC (US) 2017-03-09 — — US disclosed
US-9527829-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2016-12-27 — — US disclosed
US-20160122314-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC 2016-05-05 — — US disclosed
US-20160113914-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2016-04-28 — — US disclosed
EP-2969007-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2016-01-20 — — EP disclosed
US-9133166-B2 Histone demethylase inhibitors Quanticel Pharmaceuticals, Inc. (US) 2015-09-15 — — US disclosed
WO-2014151945-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-25 — — WO disclosed
US-20140275084-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-18 — — 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 (6 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-10273222-B2 Histone demethylase inhibitors KDM1B, KDM1A, KDM3B DRD2 4736/4885DRD3 4705/4885CHRNB2 2085/4885
US-20170066739-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B DRD2 4736/4885DRD3 4705/4885CHRNB2 2085/4885
US-20170334879-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B DRD2 4736/4885DRD3 4705/4885CHRNB2 2085/4885
US-20140275084-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B DRD2 4736/4885DRD3 4705/4885CHRNB2 2085/4885
US-20160122314-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B DRD2 4736/4885DRD3 4705/4885CHRNB2 2085/4885
US-20160113914-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B DRD2 4736/4885DRD3 4705/4885CHRNB2 2085/4885

“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.

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