SCHEMBL3825012

SCHEMBL3825012

CC(C)(C)OC(=O)NC[C@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.55
SYK P43405 1/20 0.55
CTSS P25774 3/20 0.53
CTSK P43235 2/20 0.53
CTSL P07711 1/20 0.53
CTSB P07858 1/20 0.53
CYP1A2 P05177 1/20 0.53
ACE P12821 1/20 0.51
MEN1 O00255 1/20 0.50
GAA P10253 1/20 0.50
KMT2A Q03164 1/20 0.50
APP P05067 2/20 0.48
IDO1 P14902 1/20 0.48
CPA1 P15085 2/20 0.47
CPA3 P15088 2/20 0.47
FOLH1 Q04609 2/20 0.47
CPB1 P15086 1/20 0.47
CPB2 Q96IY4 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 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
SCHEMBL825959 1.00 ATM (0.55) ATMSYKCTSSCTSKCTSL
SCHEMBL1186455 1.00 ATM (0.55) ATMSYKCTSSCTSKCTSL
SCHEMBL13816316 0.89 SYK (0.56) ATMSYKCTSSCTSKCTSL
SCHEMBL990242 0.88 CTSS (0.53) ATMSYKCTSSCTSKCTSL
SCHEMBL2799300 0.88 GAA (0.50) ATMSYKCTSSCTSKCTSL
SCHEMBL3697318 0.88 CTSS (0.56) ATMSYKCTSSCTSKMEN1
SCHEMBL2799041 0.88 GAA (0.50) ATMSYKCTSSCTSKCTSL
SCHEMBL16798329 0.88 CTSS (0.56) ATMSYKCTSSCTSKCTSL
SCHEMBL12101475 0.88 MEN1 (0.47) ATMSYKCTSSCTSKCTSL
SCHEMBL30718545 0.88 CYP17A1 (0.47) ATMSYKCTSSCTSKCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346616-A1 ROCK INHIBITORS AND USES THEREOF DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2025-11-13 US disclosed
EP-4532484-A1 ROCK INHIBITORS AND USES THEREOF DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2025-04-09 EP disclosed
CN-119173509-A ROCK inhibitors and uses thereof 迪哲(江苏)医药股份有限公司 2024-12-20 CN disclosed
EP-3825322-B1 POLYPEPTIDE COMPOUND, PHARMACEUTICAL COMPOSITION, PREPARATION METHOD AND APPLICATION THEREOF CHENGDU SINTANOVO BIOTECHNOLOGY CO LTD (CN) 2024-03-20 EP disclosed
EP-3521301-B1 POLYAMIDE COMPOUND AND USE THEREOF SICHUAN KELUN BIOTECH BIOPHARMACEUTICAL CO LTD (CN) 2024-03-06 EP disclosed
WO-2023226965-A1 ROCK INHIBITORS AND USES THEREOF DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2023-11-30 WO disclosed
US-11643436-B2 Polypeptide compound, pharmaceutical composition, preparation method and application thereof CHENGDU SINTANOVO BIOTECHNOLOGY CO., LTD. (CN) 2023-05-09 US disclosed
US-20210332052-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2021-10-28 US disclosed
US-11084847-B2 Polyamide compound and use thereof SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2021-08-10 US disclosed
EP-3825322-A1 POLYPEPTIDE COMPOUND, PHARMACEUTICAL COMPOSITION, PREPARATION METHOD AND APPLICATION THEREOF Chengdu Sintanovo Biotechnology Co., Ltd (CN) 2021-05-26 EP disclosed
WO-2016109515-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS FORMA THERAPEUTICS, INC. (US) 2016-07-07 WO disclosed
US-20160185785-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2016-06-30 US disclosed
US-20160185785-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2016-06-30 US disclosed
CN-104470899-A 4-hydroxy-isoquinoline compounds as HIF hydroxylase inhibitors FIBROGEN INC 2015-03-25 CN disclosed
EP-2834220-A1 4 -HYDROXY- ISOQUINOLINE COMPOUNDS AS HIF HYDROXYLASE INHIBITORS Fibrogen, Inc. (US) 2015-02-11 EP disclosed
US-20150038528-A1 4 -HYDROXY- ISOQUINOLINE COMPOUNDS AS HIF HYDROXYLASE INHIBITORS FIBROGEN, INC. 2015-02-05 US disclosed
WO-2013134660-A1 4 -HYDROXY- ISOQUINOLINE COMPOUNDS AS HIF HYDROXYLASE INHIBITORS FIBROGEN, INC. (US) 2013-09-12 WO disclosed
US-7820858-B2 Concise β2-amino acid synthesis via organocatalytic aminomethylation WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2010-10-26 US disclosed
EP-1625153-B1 ACYLATED LYSOBACTIN-TYPE NONADEPSIPEPTIDES AICURIS GMBH & CO KG (DE) 2009-08-26 EP disclosed
US-20080058548-A1 CONCISE BETA2-AMINO ACID SYNTHESIS VIA ORGANOCATALYTIC AMINOMETHYLATION WISCONSIN ALUMNI RESEARCH FOUNDATION (WARF) (US) 2008-03-06 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 (7 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-11084847-B2 Polyamide compound and use thereof OPRK1, OPRM1, OPRD1 ATM 4737/4885SYK 2621/4885CTSS 1537/4885
US-11643436-B2 Polypeptide compound, pharmaceutical composition, preparation method and application thereof OPRL1, OPRK1, OPRM1 ATM 4820/4885SYK 2458/4885CTSS 2397/4885
US-20250346616-A1 ROCK INHIBITORS AND USES THEREOF ROCK1, ROCK2, RHOA ATM 1532/4885SYK 1211/4885CTSS 2671/4885
US-20080058548-A1 CONCISE BETA2-AMINO ACID SYNTHESIS VIA ORGANOCATALYTIC AMINOMETHYLATION BCAT2, AADAT, BCAT1 ATM 2146/4885SYK 3374/4885CTSS 3797/4885
US-20150038528-A1 4 -HYDROXY- ISOQUINOLINE COMPOUNDS AS HIF HYDROXYLASE INHIBITORS EGLN3, HIF1AN, EGLN2 ATM 4165/4885SYK 4227/4885CTSS 4622/4885
US-20210332052-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, UBXN1 ATM 2424/4885SYK 2656/4885CTSS 595/4885
US-20160185785-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, UBXN1 ATM 2424/4885SYK 2656/4885CTSS 595/4885

“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.