SCHEMBL311871

SCHEMBL311871

CC(C)[C@H](N)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 0.46
NOS3 P29474 1/20 0.46
NOS2 P35228 1/20 0.46
SLC7A5 Q01650 1/20 0.44
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA12 O43570 1/20 0.34
CA14 Q9ULX7 1/20 0.34
DPP4 P27487 3/20 0.33
CYP2D6 P10635 2/20 0.33
LMNA P02545 2/20 0.33
KMT2A Q03164 1/20 0.33
DGAT1 O75907 1/20 0.33
FAP Q12884 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
LAP3 P28838 1/20 0.32
CYP3A4 P08684 2/20 0.32

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
SCHEMBL320155 1.00 NOS1 (0.46) NOS1NOS3NOS2SLC7A5CA1
SCHEMBL919727 1.00 NOS1 (0.46) NOS1NOS3NOS2SLC7A5CA1
Hydrochloric Acid SCHEMBL919725 0.98 NOS1 (0.45) NOS1NOS3NOS2SLC7A5CA1
Hydrochloric Acid SCHEMBL146833 0.98 NOS1 (0.45) NOS1NOS3NOS2SLC7A5CA1
Hydrochloric Acid SCHEMBL146832 0.98 NOS1 (0.45) NOS1NOS3NOS2SLC7A5CA1
Trifluoroacetic Acid SCHEMBL28911781 0.88 NOS1 (0.40) NOS1NOS3NOS2SLC7A5CA1
Trifluoroacetic Acid SCHEMBL28911780 0.88 NOS1 (0.40) NOS1NOS3NOS2SLC7A5CA1
SCHEMBL28062530 0.87 NOS1 (0.46) NOS1NOS3NOS2SLC7A5CA1
SCHEMBL6565617 0.86 NOS1 (0.46) NOS1NOS3NOS2SLC7A5CA1
SCHEMBL31107708 0.86 NOS1 (0.46) NOS1NOS3NOS2SLC7A5CA1

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 1052 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119470406-A Phthalic dicarboxaldehyde disinfectant concentration detection test paper and preparation method thereof 山东新华莎罗雅生物技术有限公司 2025-02-18 CN claimed
CN-119241385-A Beta-acyloxy enamide derivative and preparation method and application thereof 江西师范大学 2025-01-03 CN claimed
CN-118239879-A Method for preparing 3-substituted oxindole, dihydroisoindigo and tetra-substituted ethane based on primary amine and application of primary amine 泰山学院 2024-06-25 CN claimed
CN-109928908-B Preparation method and intermediate of drug-linker MC-MMAF for antibody drug conjugate 联宁(苏州)生物制药有限公司 2022-05-03 CN claimed
CN-110269858-B Twin medicine for treating ischemic stroke and preparation method thereof 贵州医科大学 2021-07-09 CN claimed
CN-110269858-A It is a kind of to treat twin medicine of cerebral arterial thrombosis and preparation method thereof 贵州医科大学 2019-09-24 CN claimed
JP-61282337-A None JP disclosed
JP-59163347-A None JP disclosed
CN-122070146-A Antibody coupling medicine, preparation method and application thereof 杭州爱科瑞思生物医药有限公司 2026-05-19 CN disclosed
WO-2026098684-A1 HETEROCYCLIC COMPOUND AS KRAS INHIBITOR, PREPARATION THEREFOR AND THERAPEUTIC USE THEREOF 上海科州药物股份有限公司 2026-05-15 WO disclosed
EP-4733307-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND USING MIXED ANHYDRIDE PROCEDURE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2026-04-29 EP disclosed
US-20260102501-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NUVATION BIO INC (US) 2026-04-16 US disclosed
US-12600699-B2 Thiosemicarbazates and uses thereof THE FEINSTEIN INSTITUTES FOR MEDICAL RESEARCH (US) 2026-04-14 US disclosed
JP-S61282337-A PRODUCTION OF OPTICALLY ACTIVE BETA-SUBSTITUTED DELTAKETOCARBOXYLIC ACID OR ESTER THEREOF KURARAY CO LTD 1986-12-12 JP disclosed
US-4526896-A Microbiocides RIKER LABORATORIES, INC. (US) 1985-07-02 US disclosed
EP-0144290-A2 Substituted ethylenediamine derivatives CIBA-GEIGY AG (CH) 1985-06-12 EP disclosed
JP-S59163347-A PREPARATION OF OPTICALLY ACTIVE ALPHA,ALPHA-DISUBSTITUTED-BETA- KETOESTER KURARAY CO LTD 1984-09-14 JP disclosed
US-4237046-A VASODILATION BOARD OF REGENTS THE, THE UNIVERSITY OF TEXAS SYSTEM 1980-12-02 US disclosed
US-4122090-A Cyclic esters of 3,4-dihydroxy-thiophene-1,1-dioxide compounds and 3,4-dihydroxy-cyclopentadienone compounds BASF AKTIENGESELLSCHAFT (DE) 1978-10-24 US disclosed
US-4111933-A PROTECTION OF FUNCTIONAL GROUPS DURING REACTION AND THEIR SUBSEQUENT RESTORATION BAYER AKTIENGESELLSCHAFT (DE) 1978-09-05 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 (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-20260102501-A1 ANTI-CANCER NUCLEAR HORMONE RECEPTOR-TARGETING COMPOUNDS NR5A1, NR5A2, NR3C1 NOS1 3798/4885NOS3 3975/4885NOS2 4518/4885
US-12600699-B2 Thiosemicarbazates and uses thereof MET, THRB, ABAT NOS1 828/4885NOS3 1235/4885NOS2 1000/4885

“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.