SCHEMBL4082097

SCHEMBL4082097

NC(=O)c1sc(-c2ccsc2)cc1N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 8/20 1.00
MAPT P10636 6/20 1.00
ALDH1A1 P00352 4/20 1.00
HDAC6 Q9UBN7 1/20 1.00
CDC7 O00311 1/20 0.65
DBF4 Q9UBU7 1/20 0.65
CYP1A2 P05177 2/20 0.64
CYP3A4 P08684 2/20 0.64
CYP2C9 P11712 2/20 0.64
BTK Q06187 1/20 0.64
CHUK O15111 1/20 0.60
CYP2C19 P33261 1/20 0.60
TUBB4A P04350 2/20 0.59
TUBB P07437 2/20 0.59
TUBA3C P0DPH7 2/20 0.59
TUBA1B P68363 2/20 0.59
TUBA4A P68366 2/20 0.59
TUBB4B P68371 2/20 0.59
TUBB3 Q13509 2/20 0.59
TUBB2A Q13885 2/20 0.59

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
SCHEMBL7055888 0.87 IKBKB (0.77) IKBKBMAPTALDH1A1HDAC6CDC7
SCHEMBL7052936 0.82 IKBKB (0.69) IKBKBMAPTALDH1A1HDAC6CDC7
SCHEMBL7057054 0.82 MAPT (0.69) IKBKBMAPTALDH1A1HDAC6CDC7
SCHEMBL1382279 0.79 IKBKB (1.00) IKBKBMAPTALDH1A1HDAC6CYP1A2
SCHEMBL612267 0.79 CDC7 (1.00) IKBKBMAPTALDH1A1HDAC6CDC7
SCHEMBL6612593 0.78 IKBKB (0.76) IKBKBMAPTALDH1A1HDAC6CDC7
SCHEMBL1847243 0.78 IKBKB (1.00) IKBKBMAPTALDH1A1HDAC6CDC7
SCHEMBL5898679 0.77 IKBKB (0.64) IKBKBMAPTALDH1A1HDAC6CDC7
SCHEMBL6608113 0.77 IKBKB (0.73) IKBKBMAPTALDH1A1HDAC6CDC7
SCHEMBL4097325 0.75 IKBKB (1.00) IKBKBMAPTALDH1A1HDAC6CDC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250263669-A1 INDUCED TOTIPOTENT STEM CELLS AND PREPARATION METHOD THEREFOR UNIV TSINGHUA (CN) 2025-08-21 US claimed
US-20250082652-A1 SIGNALLING-PATHWAY INHIBITOR COMBINATIONS FOR USE IN THE TREATMENT OF CANCER DISEASES UNIVERSITÄT ZU KÖLN (DE) 2025-03-13 US claimed
US-20240408145-A1 Gene Therapy OSPEDALE SAN RAFFAELE SRL (IT) 2024-12-12 US claimed
EP-4460301-A1 SIGNALLING-PATHWAY INHIBITOR COMBINATIONS FOR USE IN THE TREATMENT OF CANCER DISEASES Universität zu Köln (DE) 2024-11-13 EP claimed
EP-4419543-A1 GENE THERAPY Ospedale San Raffaele S.r.l. (IT) 2024-08-28 EP claimed
EP-3720493-B1 COMBINATIONS OF RIPK1- AND IKK-INHIBITORS FOR THE PREVENTION OR TREATMENT OF IMMUNE DISEASES UNIV KOELN (DE) 2024-07-24 EP claimed
EP-4394030-A1 INDUCED TOTIPOTENT STEM CELLS AND PREPARATION METHOD THEREFOR Tsinghua University (CN) 2024-07-03 EP claimed
WO-2023131576-A1 SIGNALLING-PATHWAY INHIBITOR COMBINATIONS FOR USE IN THE TREATMENT OF CANCER DISEASES UNIVERSITÄT ZU KÖLN (DE) 2023-07-13 WO claimed
EP-4209213-A1 SIGNALLING-PATHWAY INHIBITOR COMBINATIONS FOR USE IN THE TREATMENT OF CANCER DISEASES Universität zu Köln (DE) 2023-07-12 EP claimed
WO-2023066735-A1 GENE THERAPY OSPEDALE SAN RAFFAELE S.R.L. (IT) 2023-04-27 WO claimed
EP-3313819-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER Case Western Reserve University (US) 2018-05-02 EP claimed
US-9889180-B2 Method of treating cancer AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2018-02-13 US claimed
WO-2016210134-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER CASE WESTERN RESERVE UNIVERSITY (US) 2016-12-29 WO claimed
US-20150258175-A1 METHOD OF TREATING CANCER AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-09-17 US claimed
EP-2908843-A1 METHOD OF TREATING CANCER Agency For Science, Technology And Research (SG) 2015-08-26 EP claimed
WO-2014077784-A1 METHOD OF TREATING CANCER AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2014-05-22 WO claimed
US-7166639-B2 NF-κB inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2007-01-23 US claimed
US-20040192943-A1 Nf-kappab inhibitors SMITHKLINE BEECHAM CORPORATION 2004-09-30 US claimed
EP-1444010-A2 HETEROAROMATIC CARBOXAMIDE DERIVATIVES FOR THE TREATMENT OF INFLAMMATION Pharmacia Corporation (US) 2004-08-11 EP claimed
WO-2003037886-A2 HETEROAROMATIC CARBOXAMIDE DERIVATIVES FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2003-05-08 WO claimed

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-20040192943-A1 Nf-kappab inhibitors NFKBIA, IKBKB, IKBKG IKBKB 2/4885MAPT 1500/4885ALDH1A1 3660/4885
US-20240408145-A1 Gene Therapy MCL1, DNASE1L3, CDKN1A IKBKB 334/4885MAPT 3015/4885ALDH1A1 874/4885

“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.