SCHEMBL1003555

SCHEMBL1003555

CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.77
CTSL P07711 2/20 0.76
CTSS P25774 1/20 0.76
CTSK P43235 1/20 0.76
SCN9A Q15858 1/20 0.70
TACR1 P25103 2/20 0.70
MAPT P10636 2/20 0.68
TP53 P04637 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.66
ALOX15 P16050 1/20 0.66
SSTR3 P32745 1/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
ITGB2 P05107 1/20 0.62
ICAM1 P05362 1/20 0.62
ITGAL P20701 1/20 0.62
ECE1 P42892 2/20 0.60

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
SCHEMBL29367687 1.00 ACE (0.77) ACECTSLCTSSCTSKSCN9A
SCHEMBL850438 1.00 ACE (0.77) ACECTSLCTSSCTSKSCN9A
SCHEMBL1486167 1.00 ACE (0.77) ACECTSLCTSSCTSKSCN9A
SCHEMBL30976323 1.00 ACE (0.77) ACECTSLCTSSCTSKSCN9A
Hydrochloric Acid SCHEMBL31472643 0.99 ACE (0.75) ACECTSLCTSSCTSKSCN9A
SCHEMBL30699849 0.99 ACE (0.75) ACECTSLCTSSCTSKSCN9A
Fluoride SCHEMBL7445962 0.99 ACE (0.75) ACECTSLCTSSCTSKSCN9A
Fluoride SCHEMBL7445954 0.99 ACE (0.75) ACECTSLCTSSCTSKSCN9A
SCHEMBL11403615 0.96 ACE (0.84) ACECTSLCTSSCTSKSCN9A
SCHEMBL27871524 0.96 CTSL (0.76) ACECTSLCTSSCTSKSCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122010656-A Application of oxyalkylisourea in introducing methyl and isotopically-labeled methyl 陕西师范大学 2026-05-12 CN claimed
CN-119528812-B Double amino acid-genipin derivative and preparation method and application thereof 广东工业大学 2025-06-03 CN claimed
CN-119241385-B Beta-acyloxy enamide derivative and preparation method and application thereof 江西师范大学 2025-03-25 CN claimed
CN-119528812-A Double amino acid-genipin derivative and preparation method and application thereof 广东工业大学 2025-02-28 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-118324850-B Broad-spectrum macrolide compound and preparation and application thereof 杭州贝普泰生物医药有限公司 2025-01-03 CN claimed
CN-118324850-A Broad-spectrum macrolide compound and preparation and application thereof 杭州贝普泰生物医药有限公司 2024-07-12 CN claimed
CN-113698457-B Preparation method of gonadorelin acetate 上海丽珠制药有限公司 2024-06-11 CN claimed
CN-118085005-A 18 Beta-glycyrrhetinic acid derivative and preparation method and application thereof 石河子大学 2024-05-28 CN claimed
CN-115724780-B Acylthiourea compound based on hydrophobic tag, preparation method thereof and application of acylthiourea compound in resisting influenza A virus 武汉大学 2024-04-26 CN claimed
CN-103214552-B Synthesis and application of multi-site modified endomorphin-1 analogue UNIV LANZHOU 2015-01-21 CN claimed
CN-103214552-A Synthesis and application of multi-site modified endomorphin-1 analogue UNIV LANGZHOU 2013-07-24 CN claimed
CN-102558297-B Endomorphin-1 analogue modified by alpha-alkenyl-beta-amino acid and composition and application thereof UNIV LANGZHOU 2013-07-17 CN claimed
CN-102558297-A Endomorphin-1 analogue modified by alpha-alkenyl-beta-amino acid and composition and application thereof UNIV LANGZHOU 2012-07-11 CN claimed
CN-100590068-C Method for preparing primary amine carbon nano tube UNIV TONGJI 2010-02-17 CN claimed
CN-101177259-A Method for preparing primary amine carbon nano tube UNIV TONGJI (CN) 2008-05-14 CN claimed
US-6951946-B2 Large scale synthesis of 1,2,4- and 1,3,4-oxadiazole carboxylates LEXICON PHARMACEUTICALS, INC. (US) 2005-10-04 US claimed
US-20050154211-A1 Large scale synthesis of 1,2,4- and 1,3,4- oxadiazole carboxylates KOLB HARTMUTH C (US) 2005-07-14 US claimed
US-20040019215-A1 Large scale synthesis of 1,2,4- and 1,3,4-oxadiazole carboxylates LEXICON PHARMACEUTICALS, INC. 2004-01-29 US claimed
WO-1990006937-A1 DERIVATIVES OF TETRAPEPTIDES AS CCK AGONISTS ABBOTT LABORATORIES (US) 1990-06-28 WO 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-20050154211-A1 Large scale synthesis of 1,2,4- and 1,3,4- oxadiazole carboxylates OXA1L, ODC1, CYP4B1 ACE 1014/4885CTSL 4371/4885CTSS 2627/4885
US-20040019215-A1 Large scale synthesis of 1,2,4- and 1,3,4-oxadiazole carboxylates OXA1L, ODC1, CYP4B1 ACE 1014/4885CTSL 4371/4885CTSS 2627/4885

“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.