SCHEMBL3783080

SCHEMBL3783080

COC(=O)[C@@H]1C[C@@H](O)CN1C(C)=O

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.72
ANPEP P15144 8/20 0.72
ATM Q13315 1/20 0.65
ALDH1A1 P00352 1/20 0.59
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PEPD P12955 1/20 0.40
VHL P40337 1/20 0.38

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
SCHEMBL3783083 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3788774 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3788772 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3789111 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3784082 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL10793356 1.00 MMP2 (0.72) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL996114 0.85 ALDH1A1 (0.59) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL8401942 0.85 ALDH1A1 (0.59) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL3272061 0.85 ALDH1A1 (0.59) MMP2ANPEPATMALDH1A1MEN1
SCHEMBL8401692 0.85 ALDH1A1 (0.59) MMP2ANPEPATMALDH1A1MEN1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103936644-A Method for preparing zofenopril calcium SHANGHAI HAINI PHARMACEUTICAL CO LTD YANGTZE RIVER PHARMACEUTICAL GROUP 2014-07-23 CN claimed
US-20230263893-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS ARVINAS OPERATIONS, INC. 2023-08-24 US disclosed
US-20210187108-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS ARVINAS OPERATIONS, INC. 2021-06-24 US disclosed
US-10772962-B2 Compounds and methods for the targeted degradation of bromodomain-containing proteins ARVINAS OPERATIONS, INC. (US) 2020-09-15 US disclosed
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2018-05-10 US disclosed
US-20170065719-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS ARVINAS OPERATIONS, INC. 2017-03-09 US disclosed
US-20140309265-A1 MACROCYCLIC COMPOUNDS FOR INHIBITION OF INHIBITORS OF APOPTOSIS ENSEMBLE THERAPEUTICS (US) 2014-10-16 US disclosed
CN-103936644-A Method for preparing zofenopril calcium SHANGHAI HAINI PHARMACEUTICAL CO LTD YANGTZE RIVER PHARMACEUTICAL GROUP 2014-07-23 CN disclosed
US-20120022040-A1 ANTIMICROBIALS AMPLYX PHARMACEUTICALS, INC. 2012-01-26 US disclosed
US-8067442-B2 Heterocyclic antiviral compounds ROCHE PALO ALTO LLC (US) 2011-11-29 US disclosed
US-20100174096-A1 Methods for Production of Optically Active Fluoropyrrolidine Derivatives IM&T RESEARCH, INC. (US) 2010-07-08 US disclosed
US-20100081658-A1 HETEROCYCLIC ANTIVIRAL COMPOUNDS ROCHE PALO ALTO LLC 2010-04-01 US disclosed
US-7226942-B2 2-amino-4-functionalized tetralin derivatives and related glycogen phosphorylase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-06-05 US disclosed
US-7226942-B2 2-amino-4-functionalized tetralin derivatives and related glycogen phosphorylase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-06-05 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 (9 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-10772962-B2 Compounds and methods for the targeted degradation of bromodomain-containing proteins BRPF3, STUB1, BRDT MMP2 2226/4885ANPEP 902/4885ATM 2985/4885
US-20100174096-A1 Methods for Production of Optically Active Fluoropyrrolidine Derivatives QDPR, FDPS, DPYD MMP2 2155/4885ANPEP 491/4885ATM 4690/4885
US-20140309265-A1 MACROCYCLIC COMPOUNDS FOR INHIBITION OF INHIBITORS OF APOPTOSIS API5, BIRC5, BAD MMP2 2035/4885ANPEP 1414/4885ATM 1240/4885
US-20120022040-A1 ANTIMICROBIALS PAM, MPO, OXA1L MMP2 828/4885ANPEP 75/4885ATM 3232/4885
US-20180125821-A1 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE CRBN, VHL, UBQLN2 MMP2 3799/4885ANPEP 1757/4885ATM 959/4885
US-20210187108-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS BRPF3, STUB1, BRDT MMP2 2226/4885ANPEP 902/4885ATM 2985/4885
US-20230263893-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS BRPF3, STUB1, BRDT MMP2 2226/4885ANPEP 902/4885ATM 2985/4885
US-20170065719-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS BRPF3, STUB1, BRDT MMP2 2226/4885ANPEP 902/4885ATM 2985/4885
US-20100081658-A1 HETEROCYCLIC ANTIVIRAL COMPOUNDS EIF2AK2, POLR2A, HCCS MMP2 1769/4885ANPEP 1386/4885ATM 4266/4885

“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.