SCHEMBL355730

SCHEMBL355730

CC(C)C[C@H](N)C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
ANPEP P15144 1/20 0.52
RNPEP Q9H4A4 1/20 0.52
DNPEP Q9ULA0 1/20 0.52
CTSK P43235 4/20 0.51
CTSB P07858 2/20 0.50
CTSS P25774 2/20 0.48
CTSL P07711 1/20 0.48
IDO1 P14902 1/20 0.48
SLC15A1 P46059 1/20 0.48
SLC1A1 P43005 1/20 0.48
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL728728 1.00 ALDH1A1 (0.53) ALDH1A1ANPEPRNPEPDNPEPCTSK
SCHEMBL353695 1.00 ALDH1A1 (0.53) ALDH1A1ANPEPRNPEPDNPEPCTSK
Hydrochloric Acid SCHEMBL7365467 0.98 ALDH1A1 (0.51) ALDH1A1ANPEPRNPEPDNPEPCTSK
Hydrochloric Acid SCHEMBL1810902 0.98 ALDH1A1 (0.51) ALDH1A1ANPEPRNPEPDNPEPCTSK
Hydrochloric Acid SCHEMBL9697973 0.98 ALDH1A1 (0.51) ALDH1A1ANPEPRNPEPDNPEPCTSK
Oxalic Acid SCHEMBL4393417 0.95 ANPEP (0.49) ALDH1A1ANPEPRNPEPDNPEPCTSK
Oxalic Acid SCHEMBL4393420 0.95 ANPEP (0.49) ALDH1A1ANPEPRNPEPDNPEPCTSK
Toluene SCHEMBL27746059 0.94 ANPEP (0.48) ALDH1A1ANPEPRNPEPDNPEPCTSK
Alcohol SCHEMBL28297582 0.94 ANPEP (0.48) ALDH1A1ANPEPRNPEPDNPEPCTSK
Phenylalanine SCHEMBL11683484 0.91 SLC7A5 (0.61) ALDH1A1ANPEPRNPEPDNPEPCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120192379-A Marine cyclic peptide and synthesis method and application thereof 内蒙古大学 2025-06-24 CN claimed
CN-119161409-A ((S) -2-amino-3- (4- (benzyloxy) phenyl) propionyl) -L-leucine benzyl ester hydrochloride, and preparation method and application thereof 成都普康唯新生物科技有限公司 2024-12-20 CN claimed
EP-3275864-B1 COMPOUND OF 3-HYDROXYL PYRIDINE, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE THEREOF SHENYANG SUNSHINE PHARMACEUTICAL CO LTD (CN) 2019-08-14 EP claimed
US-10149841-B2 Compound of 3-hydroxyl pyridine, preparation method thereof and pharmaceutical use thereof SHENYANG SUNSHINE PHARMACEUTICAL CO. LTD. (CN) 2018-12-11 US claimed
US-20180117021-A1 COMPOUND OF 3-HYDROXYL PYRIDINE, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE THEREOF SHENYANG SUNSHINE PHARMACEUTICAL CO., LTD. (CN) 2018-05-03 US claimed
EP-3275864-A1 COMPOUND OF 3-HYDROXYL PYRIDINE, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE THEREOF Shenyang Sunshine Pharmaceutical Co., Ltd. (CN) 2018-01-31 EP claimed
CN-102320950-B Method for synthesizing acetic acid through carbonylation SHANGHAI HUAYI GROUP CO 2015-05-13 CN claimed
CN-103333089-A Crystal form of N-[(2S, 3R)-4-phenyl-3-benzyl-3-formylaminobenzoxy-2-hydroxybutyryl]-L-benzyl leucine and preparation method thereof SHENZHEN MAIN LUCK PHARMACEUTICALS INC 2013-10-02 CN claimed
CN-102241693-B N,N'-di-(1-methyl-beta-carboline-3-formyl)-lysly aminoacid benzyl esters, synthetic method thereof and application thereof UNIV CAPITAL MEDICAL SCIENCES 2013-08-28 CN claimed
CN-102250202-B 1-paranitrophenyl-beta-carboline-3-formyl amine acid carbamates and synthesis method and use thereof UNIV CAPITAL MEDICAL SCIENCES 2013-08-28 CN claimed
CN-101497615-B Substituted purine, preparation and use in medicine ZHEJIANG MED XINCHANG PHARM 2010-12-15 CN claimed
CN-101906102-A Beta-carboline alkaloid derivative, preparation method and application thereof UNIV CAPITAL MEDICAL 2010-12-08 CN claimed
CN-101891647-A Preparation method for ubenimex APELOA KANGYU PHARMACEUTICAL CO LTD 2010-11-24 CN claimed
CN-101658800-A Catalyst system for use in preparation of acetic acid and acetic anhydride or synchronous preparation of acetic acid and acetic anhydride and preparation method thereof SHANGHAI COKING & CHEMICAL COR 2010-03-03 CN claimed
CN-101659607-A Method for preparing acetic acid and acetic anhydride respectively or synchronously SHANGHAI COKING & CHEMICAL COR 2010-03-03 CN claimed
CN-100572382-C The chemical sproof heterogeneous ring compound of reversing tumor cell, its preparation method and application UNIV CAPITAL MEDICAL (CN) 2009-12-23 CN claimed
CN-101597289-A 2-tryptophyl-beta-tetrahydro carboline-3-formyol amino-acid benzyl ester and its production and application UNIV CAPITAL MEDICAL (CN) 2009-12-09 CN claimed
CN-101597290-A β-Ka Lin-3-formyl tryptophyl amino-acid benzyl ester and its production and application UNIV CAPITAL MEDICAL (CN) 2009-12-09 CN claimed
CN-101497615-A Substituted purine, preparation and use in medicine XINCHANG PHARMACEUTICAL FACTORY ZHEJIANG MEDICINE CO LTD (CN) 2009-08-05 CN claimed
CN-101239979-A Heterocyclic compound capable of inversing tumor cell drug tolerance, preparation method and application thereof UNIV CAPITAL MEDICAL SCIENCES (CN) 2008-08-13 CN 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-20180117021-A1 COMPOUND OF 3-HYDROXYL PYRIDINE, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE THEREOF EGLN3, EGLN2, P4HA1 ALDH1A1 243/4885ANPEP 2473/4885RNPEP 1790/4885
US-10149841-B2 Compound of 3-hydroxyl pyridine, preparation method thereof and pharmaceutical use thereof EGLN3, EGLN2, P4HA1 ALDH1A1 243/4885ANPEP 2473/4885RNPEP 1790/4885

“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.