SCHEMBL29441888

SCHEMBL29441888

N#Cc1cccc(C(=O)O)c1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.62
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA6 P23280 1/20 0.52
CA9 Q16790 1/20 0.52
XDH P47989 1/20 0.51
SLC22A12 Q96S37 1/20 0.51
MRGPRX4 Q96LA9 3/20 0.51
AKR1C3 P42330 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
GRM5 P41594 1/20 0.49
HTT P42858 1/20 0.49
KMO O15229 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL60691 1.00 GSK3B (0.62) GSK3BCA12CA1CA2CA6
SCHEMBL27804665 0.98 GSK3B (0.61) GSK3BCA12CA1CA2CA6
Hydrochloric Acid SCHEMBL2031438 0.98 GSK3B (0.61) GSK3BCA12CA1CA2CA6
SCHEMBL11706688 0.98 GSK3B (0.61) GSK3BCA12CA1CA2CA6
SCHEMBL27820119 0.98 GSK3B (0.61) GSK3BCA12CA1CA2CA6
SCHEMBL6832704 0.93 GSK3B (0.56) GSK3BXDHSLC22A12MRGPRX4
SCHEMBL5529069 0.89 XDH (0.62) GSK3BXDHSLC22A12KMO
SCHEMBL4030533 0.87 GSK3B (0.54) GSK3BMRGPRX4HTTHSD17B10
SCHEMBL29724115 0.86 GSK3B (0.57) GSK3BXDHSLC22A12MRGPRX4GRM5
SCHEMBL6895867 0.85 GSK3B (0.60) GSK3BMRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025243250-A1 A PROCESS FOR THE PREPARATION OF 3-[5-(2-FLUOROPHENYL)-1,2,4-OXADIAZOL-3-YL]BENZOIC ACID BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2025-11-27 WO claimed
WO-2025126110-A1 ENT1 INHIBITORS IN COMBINATION WITH BISPECIFIC ANTIBODIES iTeos Belgium SA (BE) 2025-06-19 WO claimed
CN-120020114-A Preparation method of N-alkenyl amide compound 中国石油化工股份有限公司 2025-05-20 CN claimed
EP-4148039-B1 METHOD FOR PREPARING PHTHALONITRILE-BASED COMPOUND KOREA KUMHO PETROCHEMICAL CO LTD (KR) 2026-03-11 EP disclosed
WO-2025243250-A1 A PROCESS FOR THE PREPARATION OF 3-[5-(2-FLUOROPHENYL)-1,2,4-OXADIAZOL-3-YL]BENZOIC ACID BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2025-11-27 WO disclosed
WO-2025202864-A1 ENT1 INHIBITORS IN COMBINATION WITH ONCOLYTIC VIRUSES AND THEIR USE IN THE TREATMENT OF CANCER iTeos Belgium SA (BE) 2025-10-02 WO disclosed
US-12415778-B2 Method for preparing phthalonitrile-based compound KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2025-09-16 US disclosed
US-12410210-B2 Neuroactive steroids and their methods of use SAGE THERAPEUTICS, INC. (US) 2025-09-09 US disclosed
WO-2025126110-A1 ENT1 INHIBITORS IN COMBINATION WITH BISPECIFIC ANTIBODIES iTeos Belgium SA (BE) 2025-06-19 WO disclosed
WO-2025104613-A1 ENT1 INHIBITORS IN COMBINATION WITH CHECKPOINT INHIBITORS iTeos Belgium SA (BE) 2025-05-22 WO disclosed
CN-120020114-A Preparation method of N-alkenyl amide compound 中国石油化工股份有限公司 2025-05-20 CN disclosed
WO-2023038411-A1 METHOD FOR PREPARING PHTHALONITRILE-BASED COMPOUND 금호석유화학 주식회사 2023-03-16 WO disclosed
EP-4148039-A1 METHOD FOR PREPARING PHTHALONITRILE-BASED COMPOUND Korea Kumho Petrochemical Co., Ltd. (KR) 2023-03-15 EP disclosed
CN-115784932-A Method for preparing phthalonitrile compounds 锦湖石油化学株式会社 2023-03-14 CN disclosed
EP-4143195-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 Janssen Pharmaceutica NV (BE) 2023-03-08 EP disclosed
WO-2023279938-A1 2,6,8-POLYSUBSTITUTED IMIDAZO[1,2-A]PYRAZINE, AND SYNTHESIS METHOD THEREFOR AND USE THEREOF 无锡市第二人民医院 2023-01-12 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
WO-2022140520-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS ESCIENT PHARMACEUTICALS, INC. (US) 2022-06-30 WO disclosed
EP-3997081-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS Escape Bio, Inc. (US) 2022-05-18 EP disclosed
WO-2022035805-A1 SUBSTITUTED 1,2,4-OXADIAZOLES AS SMALL MOLECULE INHIBITORS OF UBIQUITIN-SPECIFIC PROTEASE 28 DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-02-17 WO 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-12410210-B2 Neuroactive steroids and their methods of use NR3C2, MC2R, NR3C1 GSK3B 524/4885CA12 2114/4885CA1 1422/4885
US-12415778-B2 Method for preparing phthalonitrile-based compound PNN, INF2, DCX GSK3B 4837/4885CA12 2449/4885CA1 317/4885

“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.