SCHEMBL3957201

SCHEMBL3957201

COc1ccc(-c2nc(C(=O)O)cs2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.69
KDM4E B2RXH2 4/20 0.66
RAB9A P51151 2/20 0.66
NPC1 O15118 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
HPGD P15428 2/20 0.63
TLR7 Q9NYK1 1/20 0.61
MAPT P10636 3/20 0.57
POLB P06746 1/20 0.56
ATM Q13315 1/20 0.56
CDC25A P30304 1/20 0.55
CDC25B P30305 1/20 0.55
LDHA P00338 1/20 0.54
RECQL P46063 1/20 0.54
TDP1 Q9NUW8 1/20 0.52
PTGER1 P34995 2/20 0.52
HPGDS O60760 1/20 0.51
CYP19A1 P11511 1/20 0.51

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
SCHEMBL29999179 0.88 TLR7 (0.61) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL20988524 0.86 TLR7 (0.63) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL14481411 0.86 TLR7 (0.63) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL20988339 0.86 TLR7 (0.60) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL24247810 0.85 TLR7 (0.58) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL9823724 0.84 ALDH1A1 (0.63) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL20646867 0.84 TLR7 (0.57) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL29660311 0.84 ALDH1A1 (0.64) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL25003939 0.82 TLR7 (0.66) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL5342437 0.82 ALDH1A1 (0.65) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111848545-B 1- (2- (4-methoxyphenyl) thiazole-4-yl) ethylamine and synthetic method thereof 南通大学 2022-08-12 CN claimed
CN-111848545-A 1- (2- (4-methoxyphenyl) thiazole-4-yl) ethylamine and synthetic method thereof 南通大学 2020-10-30 CN claimed
US-20260062407-A1 PEROXIREDOXIN 3 INHIBITORS AND METHODS OF USE FOR TREATING CANCER UNIV WAKE FOREST HEALTH SCIENCES (US) 2026-03-05 US disclosed
US-20250381278-A1 PEROXIREDOXIN 3 INHIBITORS AND METHODS OF USE FOR TREATING CANCER UNIV WAKE FOREST HEALTH SCIENCES (US) 2025-12-18 US disclosed
EP-4577211-A2 PEROXIREDOXIN 3 INHIBITORS AND METHODS OF USE FOR TREATING CANCER Wake Forest University Health Sciences (US) 2025-07-02 EP disclosed
US-20250011316-A1 PEROXIREDOXIN 3 INHIBITORS AND METHODS OF USE FOR TREATING CANCER WAKE FOREST UNIVERSITY HEALTH SCIENCES 2025-01-09 US disclosed
WO-2024044744-A2 PEROXIREDOXIN 3 INHIBITORS AND METHODS OF USE FOR TREATING CANCER WAKE FOREST UNIVERSITY HEALTH SCIENCES (US) 2024-02-29 WO disclosed
WO-2024044744-A2 PEROXIREDOXIN 3 INHIBITORS AND METHODS OF USE FOR TREATING CANCER WAKE FOREST UNIVERSITY HEALTH SCIENCES (US) 2024-02-29 WO disclosed
WO-2023170024-A1 CAMK2 MODULATORS AND THEIR USE IN MEDICINE UNIVERSITY OF COPENHAGEN (DK) 2023-09-14 WO disclosed
CN-111848545-B 1- (2- (4-methoxyphenyl) thiazole-4-yl) ethylamine and synthetic method thereof 南通大学 2022-08-12 CN disclosed
CN-111848545-A 1- (2- (4-methoxyphenyl) thiazole-4-yl) ethylamine and synthetic method thereof 南通大学 2020-10-30 CN disclosed
US-20160311833-A1 NOVEL INDAZOLECARBOXAMIDES, PROCESSES FOR THEIR PREPARATION, PHARMACEUTICAL PREPARATIONS COMPRISING THEM AND THEIR USE FOR PRODUCING MEDICAMENTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-10-27 US disclosed
US-9206142-B2 Anilinopiperazine derivatives and methods of use thereof MERCK SHARP & DOHME CORP. (US) 2015-12-08 US disclosed
US-20120328691-A1 ANILINOPIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF MERCK SHARP & DOHME LLC 2012-12-27 US disclosed
CN-101370796-B Thiazoles as 11 beta-HSD1 inhibitors HOFFMANN LA ROCHE 2012-10-10 CN disclosed
EP-2078003-A1 ANILINOPIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2009-07-15 EP disclosed
WO-2008054702-A1 ANILINOPIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2008-05-08 WO disclosed
EP-0262873-B1 N-TETRAZOLYL THIAZOLECARBOXAMIDE DERIVATIVES AND THEIR USE SAWAI PHARMACEUTICAL CO., LTD. (JP) 1991-08-21 EP disclosed
US-4879295-A ANTIALLERGENS SAWAI PHARMACEUTICAL CO., LTD. (JP) 1989-11-07 US disclosed
EP-0262873-A1 N-tetrazolyl thiazolecarboxamide derivatives and their use SAWAI PHARMACEUTICAL CO., LTD. (JP) 1988-04-06 EP 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 (5 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-20260062407-A1 PEROXIREDOXIN 3 INHIBITORS AND METHODS OF USE FOR TREATING CANCER PRDX1, PRDX3, PRDX2 ALDH1A1 748/4885KDM4E 3228/4885RAB9A 1459/4885
US-20160311833-A1 NOVEL INDAZOLECARBOXAMIDES, PROCESSES FOR THEIR PREPARATION, PHARMACEUTICAL PREPARATIONS COMPRISING THEM AND THEIR USE FOR PRODUCING MEDICAMENTS MALT1, APC, UACA ALDH1A1 1447/4885KDM4E 1366/4885RAB9A 4531/4885
US-20120328691-A1 ANILINOPIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF MAPK15, CDK15, MAPKAPK5 ALDH1A1 3548/4885KDM4E 3595/4885RAB9A 4564/4885
US-20250011316-A1 PEROXIREDOXIN 3 INHIBITORS AND METHODS OF USE FOR TREATING CANCER PRDX1, PRDX2, PRDX6 ALDH1A1 331/4885KDM4E 2664/4885RAB9A 2759/4885
US-20250381278-A1 PEROXIREDOXIN 3 INHIBITORS AND METHODS OF USE FOR TREATING CANCER PRDX1, PRDX2, PRDX6 ALDH1A1 319/4885KDM4E 2634/4885RAB9A 2949/4885

“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.