SCHEMBL7809908

SCHEMBL7809908

CS(=O)(=O)OCCNCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 4/20 0.54
▸ DRD2 P14416 3/20 0.53
▸ DRD3 P35462 3/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ MAOA P21397 1/20 0.48
▸ CHRM2 P08172 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ SCN8A Q9UQD0 1/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA4 P22748 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ PPARG P37231 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
SCHEMBL3489405 0.83 DRD4 (0.54) DRD4DRD2DRD3KMT2AMEN1
SCHEMBL3489408 0.81 DRD4 (0.53) DRD4DRD2DRD3KMT2AMEN1
SCHEMBL21408106 0.79 CA12 (0.54) DRD4DRD2DRD3KMT2AMEN1
SCHEMBL6558520 0.76 CA1 (0.51) CA12CA1CA2CA9
SCHEMBL6589802 0.76 CA1 (0.66) KMT2AMEN1TDP1CA12CA1
SCHEMBL556793 0.76 MEN1 (0.64) DRD4DRD2DRD3KMT2AMEN1
SCHEMBL18995754 0.76 SIGMAR1 (0.63) DRD2DRD3
SCHEMBL6277903 0.75 ALDH1A1 (0.47) MAPTCA12CA2CA9
SCHEMBL19375072 0.75 DRD4 (0.58) DRD4DRD2DRD3KMT2AMEN1
SCHEMBL6422921 0.75 KMT2A (0.63) DRD4DRD2DRD3KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160272645-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES, INC. (US) 2016-09-22 — — US disclosed
WO-2015069441-A1 PYRAZOLO-, IMIDAZOLO- AND PYRROLO-PYRIDINE OR -PYRIMIDINE DERIVATIVES AS INHIBITORS O BRUTONS KINASE (BTK) MEDIVATION TECHNOLOGIES, INC. (US) 2015-05-14 — — WO disclosed
US-8905534-B2 Ink composition and image forming method FUJIFILM CORPORATION (JP) 2014-12-09 — — US disclosed
US-20140132685-A1 INK COMPOSITION AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2014-05-15 — — US disclosed
EP-0610958-B1 Intermediates in the preparation of 4-oxoquinoline-3-carboxylic acid derivatives UBE INDUSTRIES (JP) 2001-10-04 — — EP disclosed
EP-0352123-B1 4-Oxoquinoline-3-carboxylic acid derivatives, their preparation and their use UBE INDUSTRIES (JP) 1995-01-18 — — EP 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 (1 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-20160272645-A1 Heterocyclic Compounds and Methods of Use BTK, PIK3CD, PIK3CB DRD4 4350/4885DRD2 3798/4885DRD3 2898/4885

“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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