SCHEMBL944147

SCHEMBL944147

Cc1cccc(C)c1N=C=S

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.54
GABRB2 P47870 1/20 0.54
MIF P14174 1/20 0.42
ATM Q13315 3/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
HSP90AA1 P07900 1/20 0.40
ALDH1A1 P00352 4/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
ABCB11 O95342 1/20 0.39
NR3C1 P04150 1/20 0.39
ADRA2A P08913 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
ADRA2C P18825 1/20 0.39
MAOA P21397 1/20 0.39
DRD1 P21728 1/20 0.39
SLC6A4 P31645 1/20 0.39

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
SCHEMBL2001200 0.87 ALDH1A1 (0.47) GABRA1GABRB2MIFATMKMT2A
SCHEMBL1457069 0.85 GABRA1 (0.50) GABRA1GABRB2MIFATMKMT2A
SCHEMBL15589311 0.85 GABRA1 (0.46) GABRA1GABRB2MIFATMKMT2A
SCHEMBL9358244 0.82 GABRA1 (0.43) GABRA1GABRB2MIFATMKMT2A
SCHEMBL1018021 0.82 GABRA1 (0.79) GABRA1GABRB2MIFATMKMT2A
SCHEMBL1019702 0.82 GABRA1 (0.43) GABRA1GABRB2MIFATMKMT2A
SCHEMBL11415288 0.82 GABRA1 (0.46) GABRA1GABRB2MIFATMKMT2A
SCHEMBL8958496 0.80 GABRA1 (0.46) GABRA1GABRB2KMT2AMEN1ALDH1A1
SCHEMBL15051494 0.80 GABRA1 (0.46) GABRA1GABRB2ATMKMT2AMEN1
SCHEMBL508696 0.79 ATM (0.43) GABRA1GABRB2ATMKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250084759-A1 FLUORESCENT DYE OIL TRACER COMPOSITIONS SAUDI ARABIAN OIL COMPANY (SA) 2025-03-13 US claimed
CN-117945956-A Synthesis method of N-trifluoromethyl sulfonamide compound 南京理工大学 2024-04-30 CN claimed
CN-109096222-A A kind of 2,6- accelerine base thiazine chemical synthesis process 黄石法姆药业股份有限公司 2018-12-28 CN claimed
US-20160250175-A1 COMBINED APPLICATION OF ISOTHIOCYANATE COMPOUND AND ANTI-CANCER MEDICINE JC (WUXI) COMPANY, INC. (CN) 2016-09-01 US claimed
EP-3034076-A1 COMBINED APPLICATION OF ISOTHIOCYANATE COMPOUND AND ANTI-CANCER MEDICINE JC (Wuxi) COMPANY, Inc. (CN) 2016-06-22 EP claimed
CN-105267967-A Combined application of isothiocyanate-type compound and anti-cancer drug acting or affecting DNA WUXI JC PHARMACAUTICAL TECHNOLOGY INC 2016-01-27 CN claimed
CN-104415332-A Combined application between isothiocyanate-type compound and kinase inhibitor medicine in treatment of cancer WUXI JC PHARMACAUTICAL TECHNOLOGY INC 2015-03-18 CN claimed
CN-104117064-A Combined application of isothiocyanate compound and hormone medicine WUXI JC PHARMACAUTICAL TECHNOLOGY INC 2014-10-29 CN claimed
US-5043442-A Process of preparing an isothiocyanate intermediate used in the preparation of xylazine CHEMSYN SCIENCE LABORATORIES (US) 1991-08-27 US claimed
US-4614798-A IMPROVED YIELD OF INTERMEDIATE USING TETRAHYDROFURAN OR A MIXTURE OF TOLUENE AND N,N-DIMETHYLACETAMIDE AS SOLVENT VETAMIX (US) 1986-09-30 US claimed
US-12534440-B2 Compounds with copper- or zinc-activated toxicity against microbial infection KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2026-01-27 US disclosed
WO-2025078982-A1 XYLAZINE HAPTENS, IMMUNOGENS, AND PROTEIN CONJUGATES AND METHODS OF PRODUCTION AND USE THEREOF SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2025-04-17 WO disclosed
US-20250084759-A1 FLUORESCENT DYE OIL TRACER COMPOSITIONS SAUDI ARABIAN OIL COMPANY (SA) 2025-03-13 US disclosed
US-12221507-B2 Monobidentate, bis-bidentate, and tetrabidentate guanidine Group IV transition metal olefin copolymerization catalysts DOW GLOBAL TECHNOLOGIES LLC (US) 2025-02-11 US disclosed
EP-3446689-B1 ISOTHIOCYANATE COMPOUND FOR USE IN THE TREATMENT OF HYPERBILIRUBINEMIA JC WUXI COMPANY INC (CN) 2025-01-08 EP disclosed
EP-0194112-A1 3-Aryl-oxyazetidinecarboxamides having anti-muscle tension, anti-muscle spasticity, anticonvulsant and antiepilectic activity A.H. ROBINS COMPANY, INCORPORATED (US) 1986-09-10 EP disclosed
US-4418209-A ANTIULCER, ANTIARRYTHMIC, ANTIDIARRHEAL, ANTISPASMODIC, ANTIPARASITIC, AND ANTISECRETORY AGENTS WILLIAM H. RORER, INC. (US) 1983-11-29 US disclosed
US-4313885-A Furfuryl thiourea compounds AMERICAN CYANAMID COMPANY (US) 1982-02-02 US disclosed
US-4267191-A BY ADMINISTERING FURFURYL THIOUREA COMPOUNDS AMERICAN CYANAMID COMPANY (US) 1981-05-12 US disclosed
US-4194008-A INSECTICIDE, FUNGICIDE, MITICIDE, PARASITICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-03-18 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 (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-20160250175-A1 COMBINED APPLICATION OF ISOTHIOCYANATE COMPOUND AND ANTI-CANCER MEDICINE CHUK, KIT, MKI67 GABRA1 3626/4885GABRB2 3271/4885MIF 986/4885
US-12534440-B2 Compounds with copper- or zinc-activated toxicity against microbial infection TST, SLC39A11, SLC39A3 GABRA1 3181/4885GABRB2 2017/4885MIF 218/4885

“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.