SCHEMBL3497284

SCHEMBL3497284

Cc1sc(N)c(C(=O)O)c1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.61
MAPT P10636 7/20 0.61
LMNA P02545 3/20 0.61
ADORA1 P30542 3/20 0.50
GAA P10253 2/20 0.49
POLB P06746 2/20 0.47
RECQL P46063 2/20 0.47
FHIT P49789 1/20 0.46
HSD17B10 Q99714 2/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
KMT2A Q03164 1/20 0.44
CISD2 Q8N5K1 1/20 0.42
HPGD P15428 4/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ABCC1 P33527 1/20 0.40
GRM6 O15303 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 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
SCHEMBL27475039 0.84 ALDH1A1 (0.47) ALDH1A1MAPTLMNAADORA1GAA
SCHEMBL3451713 0.82 ALDH1A1 (0.56) ALDH1A1MAPTLMNAADORA1GAA
SCHEMBL20831152 0.82 ALDH1A1 (0.56) ALDH1A1MAPTLMNAADORA1GAA
SCHEMBL2807538 0.80 CISD2 (0.51) ALDH1A1MAPTLMNAADORA1GAA
SCHEMBL28773543 0.78 ALDH1A1 (0.41) ALDH1A1MAPTLMNAADORA1GAA
SCHEMBL8304526 0.78 POLB (0.52) ALDH1A1MAPTLMNAGAAPOLB
SCHEMBL1063435 0.77 KDM4E (0.60) ALDH1A1MAPTLMNAGAAPOLB
SCHEMBL1622729 0.77 ALDH1A1 (0.51) ALDH1A1MAPTLMNAADORA1GAA
SCHEMBL3066973 0.77 ALDH1A1 (0.62) ALDH1A1MAPTLMNAADORA1GAA
SCHEMBL1638729 0.77 ALDH1A1 (1.00) ALDH1A1MAPTLMNAADORA1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230278978-A1 THIOPHENE HSD17B13 INHIBITORS AND USES THEREOF INIPHARM, INC. 2023-09-07 US disclosed
US-20230278978-A1 THIOPHENE HSD17B13 INHIBITORS AND USES THEREOF INIPHARM, INC. 2023-09-07 US disclosed
US-20230278978-A1 THIOPHENE HSD17B13 INHIBITORS AND USES THEREOF INIPHARM, INC. 2023-09-07 US disclosed
CN-116323578-A Thiophene HSD17B13 inhibitor and application thereof 伊尼制药公司 2023-06-23 CN disclosed
EP-4185381-A1 THIOPHENE HSD17B13 INHIBITORS AND USES THEREOF Inipharm, Inc. (US) 2023-05-31 EP disclosed
CN-110357789-B N-substituted acrylamide derivative as DHODH inhibitor and preparation and application thereof 华东理工大学 2022-09-30 CN disclosed
US-20220081427-A1 INHIBITORS OF JUN N-TERMINAL KINASE IMAGO PHARMACEUTICALS, INC. (US) 2022-03-17 US disclosed
US-20200277285-A1 INHIBITORS OF JUN N-TERMINAL KINASE IMAGO PHARMACEUTICALS, INC. (US) 2020-09-03 US disclosed
US-20200039972-A1 INHIBITORS OF JUN N-TERMINAL KINASE IMAGO PHARMACEUTICALS, INC. (US) 2020-02-06 US disclosed
WO-2019196714-A1 N-SUBSTITUTED ACRYLAMIDE DERIVATIVE AS DHODH INHIBITOR, AND PREPARATION AND USE THEREOF 华东理工大学 2019-10-17 WO disclosed
EP-0025643-B1 OXO-PYRIDO(1,2-A)THIENOPYRIMIDINE COMPOUNDS, PROCESSES FOR THEIR PRODUCTION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID COMPOUNDS WARNER-LAMBERT COMPANY (US) 1983-08-17 EP disclosed
US-4332947-A TREATMENT OF ALLERGIES WARNER-LAMBERT COMPANY (US) 1982-06-01 US disclosed
US-4287340-A USEFUL AS ANTIALLERGENS WARNER-LAMBERT COMPANY (US) 1981-09-01 US disclosed
EP-0025643-A1 Oxo-pyrido(1,2-a)thienopyrimidine compounds, processes for their production, and pharmaceutical compositions containing said compounds WARNER-LAMBERT COMPANY (US) 1981-03-25 EP disclosed
US-4230707-A ANTIALLERGENS WARNER-LAMBERT COMPANY (US) 1980-10-28 US disclosed
US-4222946-A ANTIALLERGEN, HYPERSENSITIVITY LILLY INDUSTRIES, LIMITED (GB) 1980-09-16 US disclosed
US-4187232-A ANTIALLERGENS LILLY INDUSTRIES LIMITED (GB) 1980-02-05 US disclosed
US-4079060-A Thienopyridine-carboxylic acid derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1978-03-14 US disclosed
US-3997545-A Thienopyridine-carboxylic acid derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1976-12-14 US disclosed
US-3951989-A Thienopyridine-carboxylic acid derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) 1976-04-20 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 (4 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-20200039972-A1 INHIBITORS OF JUN N-TERMINAL KINASE CHUK, MAPK6, MAPK3 ALDH1A1 4529/4885MAPT 51/4885LMNA 1592/4885
US-20230278978-A1 THIOPHENE HSD17B13 INHIBITORS AND USES THEREOF HSD17B3, HSD17B1, HSD17B13 ALDH1A1 237/4885MAPT 2171/4885LMNA 3376/4885
US-20220081427-A1 INHIBITORS OF JUN N-TERMINAL KINASE CHUK, MAPK6, MAPK3 ALDH1A1 4529/4885MAPT 51/4885LMNA 1592/4885
US-20200277285-A1 INHIBITORS OF JUN N-TERMINAL KINASE CHUK, MAPK6, MAPK3 ALDH1A1 4529/4885MAPT 51/4885LMNA 1592/4885

“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.