SCHEMBL3078858

SCHEMBL3078858

CC(C)N(C(=S)S)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
ABCB11 O95342 1/20 0.36
CYP2E1 P05181 1/20 0.36
PTGS1 P23219 1/20 0.36
HTT P42858 1/20 0.36
GSDMD P57764 1/20 0.36
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
KMT2A Q03164 1/20 0.30

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
SCHEMBL11563773 0.97 ALDH1A1 (0.39) ALDH1A1ABCB11CYP2E1PTGS1HTT
SCHEMBL28369634 0.97 ALDH1A1 (0.39) ALDH1A1ABCB11CYP2E1PTGS1HTT
SCHEMBL28773605 0.97 ALDH1A1 (0.39) ALDH1A1ABCB11CYP2E1PTGS1HTT
SCHEMBL8677340 0.97 ALDH1A1 (0.39) ALDH1A1ABCB11CYP2E1PTGS1HTT
SCHEMBL20819787 0.97 ALDH1A1 (0.39) ALDH1A1ABCB11CYP2E1PTGS1HTT
SCHEMBL28773566 0.97 ALDH1A1 (0.39) ALDH1A1ABCB11CYP2E1PTGS1HTT
SCHEMBL11528790 0.87 TDP1 (0.40) ALDH1A1
SCHEMBL11734279 0.79 ALDH1A1 (0.46) ALDH1A1
SCHEMBL1241923 0.79 ALDH1A1 (0.43) ALDH1A1KMT2A
SCHEMBL439650 0.78 ABCB11 (0.35) ABCB11CYP2E1PTGS1HTTGSDMD

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 102 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114874499-B Graphene oxide loaded rare earth vulcanization accelerator and preparation method thereof 北京化工大学 2023-05-26 CN claimed
CN-114874499-A Graphene oxide loaded rare earth vulcanization accelerator and preparation method thereof 北京化工大学 2022-08-09 CN claimed
US-20030087840-A1 Conjugates of dithiocarbamates with pharmacologically active agents and uses therefor MEDINOX, INC. 2003-05-08 US claimed
US-6407135-B1 NITRIC OXIDE SCAVENGER COVALENTLY BONDED TO NON-STEROIDAL ANTIINFLAMMATORY AGENT OR OTHER DRUG; SIDE EFFECT REDUCTION MEDINOX, INC. 2002-06-18 US claimed
EP-1001932-A1 CONJUGATES OF DITHIOCARBAMATES WITH PHARMACOLOGICALLY ACTIVE AGENTS AND USES THEREFOR Medinox, Inc. (US) 2000-05-24 EP claimed
US-5916910-A Conjugates of dithiocarbamates with pharmacologically active agents and uses therefore MEDINOX, INC. (US) 1999-06-29 US claimed
WO-1998055453-A1 CONJUGATES OF DITHIOCARBAMATES WITH PHARMACOLOGICALLY ACTIVE AGENTS AND USES THEREFOR MEDINOX, INC. (US) 1998-12-10 WO claimed
EP-0195898-B1 A METHOD OF INCREASING THE LIGHT FATIGUE RESISTANCE OF A PHOTOCHROMIC COMPOSITION AND PHOTOCHROMIC COMPOSITION AMERICAN OPTICAL CORPORATION (US) 1988-11-02 EP claimed
EP-0134633-B1 PHOTOCHROMIC COMPOSITION AMERICAN OPTICAL CORPORATION (US) 1988-06-08 EP claimed
US-4006119-A NICKEL DIALKYLDITHIOCARBAMATE, AGING RESISTANCE R. T. VANDERBILT COMPANY, INC. (US) 1977-02-01 US claimed
EP-4724523-A1 ANTIVIBRATION RUBBER COMPOSITION COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2026-04-15 EP disclosed
EP-4419583-B1 PROCESS FOR THE PREPARATION OF A RUBBER COMPOSITION MICHELIN & CIE (FR) 2025-12-03 EP disclosed
WO-2025002349-A1 GRAPHITE COMPOSITE MATERIAL AND PREPARATION METHOD THEREFOR, NEGATIVE ELECTRODE ACTIVE MATERIAL, SECONDARY BATTERY, AND ELECTRIC DEVICE 蜂巢能源科技股份有限公司 2025-01-02 WO disclosed
WO-2024251565-A1 ANTIVIBRATION RUBBER COMPOSITION COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2024-12-12 WO disclosed
EP-4419583-A1 METHOD FOR PREPARING A RUBBER COMPOSITION COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2024-08-28 EP disclosed
EP-0042688-B1 WEED CONTROL USING 3-(4-ISOPROPYLPHENYL)-1,1-DIMETHYLUREA IN COMBINATION WITH S-2,3,3-TRICHLOROALLYL DIISOPROPYLTHIOCARBAMATE MAY & BAKER LIMITED (GB) 1984-01-18 EP disclosed
EP-0042688-A1 Weed control using 3-(4-isopropylphenyl)-1,1-dimethylurea in combination with S-2,3,3-trichloroallyl diisopropylthiocarbamate MAY & BAKER LIMITED (GB) 1981-12-30 EP disclosed
US-4155760-A NONSILVER PHOTOGRAPHY, TELLURIUM COORDINATION COMPOUND EASTMAN KODAK COMPANY (US) 1979-05-22 US disclosed
US-4155761-A TELLURIUM COORDINATION COMPOUND AND REDUCING AGENT EASTMAN KODAK COMPANY (US) 1979-05-22 US disclosed
US-4017439-A METAL OXIDES, THIADIAZINE AND DITHIOCARBAMATE ACCELERATORS R. T. VANDERBILT COMPANY, INC. (US) 1977-04-12 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 (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-20030087840-A1 Conjugates of dithiocarbamates with pharmacologically active agents and uses therefor NOS1, PTGS1, NOS2 ALDH1A1 404/4885ABCB11 1058/4885CYP2E1 795/4885

“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.