SCHEMBL18776038

SCHEMBL18776038

O=C(CS(=O)(=O)O)OC1CCCCCC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 1/20 0.49
▸ NAAA Q02083 2/20 0.47
▸ HTT P42858 2/20 0.46
▸ CYP19A1 P11511 2/20 0.44
▸ EPHX1 P07099 2/20 0.43
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ STS P08842 4/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ CA12 O43570 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ MIF P14174 1/20 0.34
▸ MAPT P10636 1/20 0.34

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
SCHEMBL17717476 1.00 CYP2C19 (0.49) CYP2C19NAAAHTTCYP19A1EPHX1
SCHEMBL18775934 1.00 CYP2C19 (0.49) CYP2C19NAAAHTTCYP19A1EPHX1
SCHEMBL18775961 1.00 CYP2C19 (0.49) CYP2C19NAAAHTTCYP19A1EPHX1
SCHEMBL18775927 1.00 CYP2C19 (0.49) CYP2C19NAAAHTTCYP19A1EPHX1
SCHEMBL15219799 0.98 NAAA (0.46) CYP2C19NAAAHTTCYP19A1EPHX1
SCHEMBL18775900 0.94 NAAA (0.42) CYP2C19NAAAHTTCYP19A1EPHX1
SCHEMBL18775928 0.88 CYP2C19 (0.42) CYP2C19NAAAHTTCYP19A1EPHX1
SCHEMBL23143133 0.85 CYP2C19 (0.44) CYP2C19NAAAHTTCYP19A1EPHX1
SCHEMBL15800922 0.81 CYP2C19 (0.46) CYP2C19NAAAHTTCYP19A1EPHX1
SCHEMBL23140775 0.81 NAAA (0.53) CYP2C19NAAAHTTCYP19A1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230140810-A1 MATERIAL FOR FORMING ADHESIVE FILM, PATTERNING PROCESS, AND METHOD FOR FORMING ADHESIVE FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-04 — — US disclosed
US-20180086948-A1 ADHESIVE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING A BIO-ELECTRODE, AND SALT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-03-29 — — US disclosed
US-20180072930-A1 ADHESIVE COMPOSITION, BIO-ELECTRODE, AND METHOD FOR MANUFACTURING A BIO-ELECTRODE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-03-15 — — US disclosed
US-20170115566-A1 RESIST COMPOSITION, PATTERNING PROCESS, AND BARIUM, CESIUM AND CERIUM SALTS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-04-27 — — 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 (2 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-20170115566-A1 RESIST COMPOSITION, PATTERNING PROCESS, AND BARIUM, CESIUM AND CERIUM SALTS CASR, LIFR, LBR CYP2C19 4640/4885NAAA 1230/4885HTT 3879/4885
US-20180086948-A1 ADHESIVE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING A BIO-ELECTRODE, AND SALT SLC9A1, FN1, EPCAM CYP2C19 3102/4885NAAA 353/4885HTT 3546/4885

“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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