SCHEMBL866005

SCHEMBL866005

Nc1cc(Cl)ccc1SSc1ccc(Cl)cc1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
CYP3A4 P08684 4/20 0.56
TSHR P16473 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
ALOX15 P16050 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
HPGD P15428 3/20 0.56
HSD17B10 Q99714 2/20 0.56
ALOX12 P18054 1/20 0.56
MAPK1 P28482 1/20 0.56
TP53 P04637 1/20 0.54
CYP1A2 P05177 3/20 0.47
CYP2C9 P11712 3/20 0.47
CYP2C19 P33261 3/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
ITGB2 P05107 1/20 0.45
ICAM1 P05362 1/20 0.45
ITGAL P20701 1/20 0.45
SLC6A2 P23975 1/20 0.45

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
SCHEMBL30811359 1.00 ALDH1A1 (0.56) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15
SCHEMBL9629853 0.85 SLC6A2 (0.57) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15
SCHEMBL110557 0.81 ALDH1A1 (0.52) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15
SCHEMBL866006 0.81 CYP3A4 (0.52) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15
SCHEMBL7453199 0.80 CYP3A4 (0.56) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15
SCHEMBL2850872 0.78 HPGD (0.58) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15
SCHEMBL3781267 0.78 SLC6A2 (0.51) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15
SCHEMBL18035387 0.76 ALDH1A1 (0.47) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15
SCHEMBL11206840 0.76 ALDH1A1 (0.47) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15
SCHEMBL19431337 0.76 ALDH1A1 (0.47) ALDH1A1CYP3A4TSHRSMN1; SMN2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119790090-A One-component (1K) curable adhesive composition 汉高股份有限及两合公司 2025-04-08 CN claimed
US-6989263-B1 Method for identifying and using compounds that inactivate HIV-1 and other retroviruses by attacking highly conserved zinc fingers in the viral nucleocapsid protein THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2006-01-24 US claimed
US-20030198648-A1 Methods for identifying compounds which inhibit binding of nucleocapsid 7 protein to HIV-1 RNA ACHILION PHARMACEUTICALS 2003-10-23 US claimed
WO-2003060098-A2 METHODS FOR IDENTIFYING COMPOUNDS WHICH INHIBIT BINDING OF NUCLEOCAPSID 7 PROTEIN TO HIV-1 RNA ACHILLION PHARMACEUTICALS, INC. (US) 2003-07-24 WO claimed
EP-0782632-B1 A METHOD FOR IDENTIFYING AND USING COMPOUNDS THAT INACTIVATE HIV-1 AND OTHER RETROVIRUSES BY ATTACKING HIGHLY CONSERVED ZINC FINGERS IN THE VIRAL NUCLEOCAPSID PROTEIN US GOV HEALTH & HUMAN SERV (US) 2003-04-16 EP claimed
US-6001555-A DISSOCIATING A ZINC FINGER BY CONTACTING THE PROTEIN WITH A DISULFIDE, A MALEIMIDE, AN ALPHA-HALOGENATED KETONE, A HYDRAZIDE, A NITRIC OXIDE OR DERIVATIVES, CUPRIC IONS, FERRIC IONS OR THEIR COMPLEXES; SYNERGISTIC EFFECTS WITH VIRICIDES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1999-12-14 US claimed
EP-0782632-A1 A METHOD FOR IDENTIFYING AND USING COMPOUNDS THAT INACTIVATE HIV-1 AND OTHER RETROVIRUSES BY ATTACKING HIGHLY CONSERVED ZINC FINGERS IN THE VIRAL NUCLEOCAPSID PROTEIN THE GOVERNMENT OF THE UNITED STATES OF AMERICA as represented by the Secretary of the Department of Health and Human Services (US) 1997-07-09 EP claimed
WO-1996009406-A9 A METHOD FOR IDENTIFYING AND USING COMPOUNDS THAT INACTIVATE HIV-1 AND OTHER RETROVIRUSES BY ATTACKING HIGHLY CONSERVED ZINC FINGERS IN THE VIRAL NUCLEOCAPSID PROTEIN 1996-05-23 WO claimed
WO-1996009406-A1 A METHOD FOR IDENTIFYING AND USING COMPOUNDS THAT INACTIVATE HIV-1 AND OTHER RETROVIRUSES BY ATTACKING HIGHLY CONSERVED ZINC FINGERS IN THE VIRAL NUCLEOCAPSID PROTEIN THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-03-28 WO claimed
US-3940371-A HYDROLYTIC AND CHEMICAL STABILITY CASE LESLIE C 1976-02-24 US claimed
JP-58032861-A None JP disclosed
US-20250180952-A1 PHOTOALIGNING MATERIALS Rolic Technologies AG (CH) 2025-06-05 US disclosed
CN-119790090-A One-component (1K) curable adhesive composition 汉高股份有限及两合公司 2025-04-08 CN disclosed
EP-4493638-A1 PHOTOALIGNING MATERIALS Rolic Technologies AG (CH) 2025-01-22 EP disclosed
CN-118871548-A Photoalignment materials 罗利克技术有限公司 2024-10-29 CN disclosed
JP-S5832861-A 2-SUBSTITUTED AMINO-4-CHLORO-THIOPHENOL DERIVATIVE AND ITS PREPARATION TOUBISHI YAKUHIN KOGYO KK 1983-02-25 JP disclosed
US-4157444-A ANTIPSYCHOTIC, NEUROLEPTIC AMERICAN CYANAMID COMPANY (US) 1979-06-05 US disclosed
US-4144235-A ANTIPSYCHOTIC, NEUROLEPTIC AMERICAN CYANAMID COMPANY (US) 1979-03-13 US disclosed
US-3976769-A INSECTICIDE AIRWICK INDUSTRIES, INC. (US) 1976-08-24 US disclosed
US-3940371-A HYDROLYTIC AND CHEMICAL STABILITY CASE LESLIE C 1976-02-24 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-20030198648-A1 Methods for identifying compounds which inhibit binding of nucleocapsid 7 protein to HIV-1 RNA MRPS27, SNRPE, NSUN2 ALDH1A1 4104/4885CYP3A4 4653/4885TSHR 4796/4885

“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.