SCHEMBL29430342

SCHEMBL29430342

O=C(O)Cc1cccnc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 1.00
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2C9 P11712 1/20 0.62
TBXAS1 P24557 9/20 0.61
AKR1B1 P15121 1/20 0.58
KDM4E B2RXH2 1/20 0.56
RECQL P46063 1/20 0.53
EPHX2 P34913 1/20 0.53

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
SCHEMBL48609 1.00 NAPRT (1.00) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Water SCHEMBL27728999 0.98 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Hydrochloric Acid SCHEMBL26689831 0.98 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
SCHEMBL986770 0.98 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Hydrochloric Acid SCHEMBL177895 0.98 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
SCHEMBL26116267 0.98 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Hydrochloric Acid SCHEMBL5332088 0.98 NAPRT (0.96) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Hydrochloric Acid SCHEMBL27823037 0.96 NAPRT (0.92) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Sulfuric Acid SCHEMBL6676982 0.93 NAPRT (0.86) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1
Alcohol SCHEMBL28317498 0.93 NAPRT (0.86) NAPRTCYP1A2CYP3A4CYP2C9TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025243208-A2 PROCESS FOR THE PREPARATION AND/OR PURIFICATION OF POLYETHYLENE GLYCOL AND ITS DERIVATIVES, OBTAINED PRODUCT AND USES THEREOF HOVIONE - FARMACIÊNCIA, SA (PT) 2025-11-27 WO claimed
CN-122031592-A Application of dragon's blood and active ingredients thereof in preparation of drugs for treating heart failure 上海中医药大学 2026-05-15 CN disclosed
WO-2025243208-A2 PROCESS FOR THE PREPARATION AND/OR PURIFICATION OF POLYETHYLENE GLYCOL AND ITS DERIVATIVES, OBTAINED PRODUCT AND USES THEREOF HOVIONE - FARMACIÊNCIA, SA (PT) 2025-11-27 WO disclosed
EP-4630434-A1 PHOSPHORAMIDATE MONOSACCHARIDES, PHARMACEUTICAL COMPOSITIONS, AND DIAGNOSTIC AND THERAPEUTIC APPLICATIONS Surio Therapeutics Co. Ltd (CN) 2025-10-15 EP disclosed
WO-2025106343-A1 ETCHING METHODS FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2025-05-22 WO disclosed
CN-114585637-B MASP-inhibitory compounds and uses thereof 拜耳公司 2025-04-15 CN disclosed
CN-119752820-A Bioreactive compositions and methods of use thereof 加利福尼亚大学董事会 2025-04-04 CN disclosed
WO-2025072539-A1 AMINO ACID COMPOUNDS WITH NITROGEN LINKERS AND USES THEREOF PLIANT THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed
WO-2025064683-A1 SMALL MOLECULE PROTEIN SYNTHESIS MODULATORS Interdict Bio, Inc. (US) 2025-03-27 WO disclosed
CN-113226356-B Activation of pyruvate kinase R 诺沃挪第克健康护理股份公司 2025-03-04 CN disclosed
CN-115151544-A Beta-lactamase inhibitors and preparation thereof 宁夏农林科学院 2022-10-04 CN disclosed
CN-110300755-B Indanyl amino aza dihydro benzofuran acetic acid, pharmaceutical composition for treating diabetes 勃林格殷格翰国际有限公司 2022-10-04 CN disclosed
CN-114901664-A Pyridone compound and application thereof 江苏先声药业有限公司 2022-08-12 CN disclosed
CN-114761082-A Azepane derivatives 日本化学药品株式会社 2022-07-15 CN disclosed
CN-114585637-A MASP inhibiting compounds and uses thereof 拜耳公司 2022-06-03 CN disclosed
WO-2022104289-A1 USE OF PHARMACEUTICAL DOSES OF NIACIN, OR AN ANALOG THEREOF, FOR THE REGRESSION OR REVERSAL OF FIBROSIS AND/OR LIVER CIRRHOSIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-05-19 WO disclosed
US-20220133716-A1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2022-05-05 US disclosed
WO-2022055814-A1 ETCHING COMPOSITIONS FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2022-03-17 WO disclosed
EP-3966226-A1 MASP INHIBITORY COMPOUNDS AND USES THEREOF Bayer Aktiengesellschaft (DE) 2022-03-16 EP disclosed
WO-2022047603-A1 BETA-LACTAMASE INHIBITORS AND THEIR PREPARATION NINGXIA ACADEMY OF AGRICULTURE AND FORESTRY SCIENCES (CN) 2022-03-10 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 (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-20220133716-A1 RORGAMMA MODULATORS AND USES THEREOF RORB, RORC, RORA NAPRT 3357/4885CYP1A2 1780/4885CYP3A4 2196/4885

“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.