SCHEMBL4994

SCHEMBL4994

COC(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
PLA2G2A P14555 1/20 0.42
PLA2G5 P39877 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
TYR P14679 1/20 0.41
FPR2 P25090 1/20 0.41
MAPK1 P28482 1/20 0.40
CA12 O43570 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA2 P00918 2/20 0.39
CA1 P00915 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 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
SCHEMBL191467 1.00 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1LMNAGAAHPGD
SCHEMBL193562 1.00 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1LMNAGAAHPGD
Hydrochloric Acid SCHEMBL27589925 0.98 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1LMNAGAAHPGD
SCHEMBL28283143 0.92 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1LMNAGAAHPGD
SCHEMBL204822 0.92 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1LMNAGAAHPGD
SCHEMBL28462179 0.85 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1LMNAGAAHPGD
SCHEMBL28462181 0.85 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1LMNAGAAHPGD
SCHEMBL192729 0.84 CA2 (0.40) ALDH1A1CA2CA1CTSS
SCHEMBL3449046 0.84 CA2 (0.40) ALDH1A1CA2CA1CTSS
SCHEMBL16499390 0.84 CA2 (0.40) ALDH1A1CA2CA1CTSS

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 1737 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122071449-A Substituted biphenyl compounds and application thereof in synthesis of cola pyrroside 北京凯因格领生物技术有限公司 2026-05-22 CN claimed
CN-117865973-A Synthesis method of S-S type aryl halogen compound 常州寅盛药业有限公司 2024-04-12 CN claimed
CN-113072615-B Preparation method of vipatavir intermediate 上海法默生物科技有限公司 2023-01-10 CN claimed
CN-114805306-A Production process of Yimitatawei 宜昌东阳光长江药业股份有限公司 2022-07-29 CN claimed
CN-114685316-A MOC-L-valine synthesis process 常州吉恩药业有限公司 2022-07-01 CN claimed
US-11344858-B2 Micro-electrolysis reactor for ultra fast, oxidant free, C—C coupling reaction and synthesis of daclatasvir analogs thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH 2022-05-31 US claimed
CN-113072615-A Preparation method of vipatavir intermediate 上海法默生物科技有限公司 2021-07-06 CN claimed
WO-2021080458-A1 PANGENOTYPIC INHIBITOR OF HEPATITIS C VIRUS NS5A PROTEIN ИВАЩЕНКО, Александр Васильевич 2021-04-29 WO claimed
CN-111825659-A Impurity hydrochloride of dalatavir hydrochloride, preparation method and application thereof 扬子江药业集团有限公司 2020-10-27 CN claimed
CN-111334265-A Clay mineral nano hydrogel plugging agent and water-based drilling fluid 西南石油大学 2020-06-26 CN claimed
CN-105294828-A Preparation method of Ombitasvir SUZHOU MIRACPHARMA TECHNOLOGY CO LTD 2016-02-03 CN claimed
US-9056860-B2 Synthesis of antiviral compound GILEAD PHARMASSET LLC (US) 2015-06-16 US claimed
CN-104520293-A Synthesis of Antiviral Compounds GILEAD PHARMASSET LLC 2015-04-15 CN claimed
EP-2855454-A1 SYNTHESIS OF ANTIVIRAL COMPOUND Gilead Pharmasset LLC (US) 2015-04-08 EP claimed
WO-2013184702-A1 SYNTHESIS OF ANTIVIRAL COMPOUND GILEAD SCIENCES, INC. (US) 2013-12-12 WO claimed
US-20130324740-A1 SYNTHESIS OF ANTIVIRAL COMPOUND GILEAD SCIENCES, INC. (US) 2013-12-05 US claimed
CN-102883718-A Analogues for the treatment or prevention of flavivirus infections VERTEX PHARMA 2013-01-16 CN claimed
EP-2515902-A1 ANALOGUES FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS Vertex Pharmaceuticals Incorporated (US) 2012-10-31 EP claimed
WO-2011079327-A1 ANALOGUES FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-06-30 WO claimed
EP-0521827-B1 Pharmacological active hydrazin derivatives and process for their preparation CIBA GEIGY AG (CH) 1996-09-25 EP claimed

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-11344858-B2 Micro-electrolysis reactor for ultra fast, oxidant free, C—C coupling reaction and synthesis of daclatasvir analogs thereof CYCS, COASY, CAT SMN1; SMN2 4798/4885ALDH1A1 532/4885LMNA 3358/4885
US-20130324740-A1 SYNTHESIS OF ANTIVIRAL COMPOUND EIF2AK2, MAVS, SARS1 SMN1; SMN2 2594/4885ALDH1A1 2746/4885LMNA 4230/4885

“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.