SCHEMBL8638604

SCHEMBL8638604

OCCSc1ccc2cc(SCCO)ccc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA7 P43166 1/20 0.48
CA13 Q8N1Q1 1/20 0.48
ANPEP P15144 1/20 0.40
BACE1 P56817 2/20 0.40
CYP3A4 P08684 3/20 0.39
TSHR P16473 2/20 0.39
HIF1A Q16665 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
ALOX15 P16050 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL3968804 0.93 CA2 (0.47) CA2CA12CA1CA7CA13
SCHEMBL3894693 0.91 ANPEP (0.51) CA2CA12CA1CA7CA13
SCHEMBL38658329 0.91 ANPEP (0.51) CA2CA12CA1CA7CA13
SCHEMBL9365248 0.89 CA2 (0.46) CA2CA12CA1CA7CA13
SCHEMBL7018220 0.88 CYP2A6 (0.43) CA2CA12CA1CA7CA13
SCHEMBL8637757 0.84 CA2 (0.61) CA2CA12CA1CA7CA13
SCHEMBL9737539 0.80 S100A4 (0.45) CA2CA12CA1CA7CA13
SCHEMBL10035840 0.80 ALDH1A1 (0.46) CA2CA12CA1CA7CA13
SCHEMBL30194874 0.79 ALPL (0.37) CA2CA12CA1CA7CA13
SCHEMBL29093237 0.79 ANPEP (0.36) CA2CA12CA1CA7CA13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240383845-A1 NAPHTHALENEDITHIOL AND DERIVATIVE THEREOF, AND PRODUCTION PROCESS AND USE FOR THE SAME SUGAI CHEMICAL INDUSTRY CO., LTD. (JP) 2024-11-21 US disclosed
EP-4378928-A1 NAPHTHALENE DITHIOL AND DERIVATIVE THEREOF, AND PRODUCTION METHODS AND USES FOR SAME SUGAI CHEMICAL INDUSTRY CO., LTD. (JP) 2024-06-05 EP disclosed
WO-2023058449-A1 NAPHTHALENE DITHIOL AND DERIVATIVE THEREOF, AND PRODUCTION METHODS AND USES FOR SAME スガイ化学工業株式会社 2023-04-13 WO disclosed
EP-0799267-B1 NAPHTALENEDICARBOXYLIC ACID POLYMERS CONTAINING ARYL THIOETHERS AND HAVING REDUCED FLUORESCENCE EASTMAN CHEM CO (US) 1998-08-05 EP disclosed
EP-0799267-A1 NAPHTALENEDICARBOXYLIC ACID POLYMERS CONTAINING ARYL THIOETHERS AND HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1997-10-08 EP disclosed
US-5554720-A Naphthalenedicarboxylic acid polymers containing aryl thioethers and having reduced fluorescene EASTMAN CHEMICAL COMPANY (US) 1996-09-10 US disclosed
WO-1996019517-A1 NAPHTALENEDICARBOXYLIC ACID POLYMERS CONTAINING ARYL THIOETHERS AND HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1996-06-27 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 (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-20240383845-A1 NAPHTHALENEDITHIOL AND DERIVATIVE THEREOF, AND PRODUCTION PROCESS AND USE FOR THE SAME HSD11B1, DHCR7, CYP17A1 CA2 3404/4885CA12 2146/4885CA1 1172/4885

“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.