SCHEMBL1531672

SCHEMBL1531672

N[C@@](CCC(=O)O)(Cc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 2/20 0.60
ARG2 P78540 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.56
HIF1A Q16665 2/20 0.56
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP1A2 P05177 1/20 0.56
THRB P10828 1/20 0.56
KMT2A Q03164 1/20 0.56
KEAP1 Q14145 1/20 0.47
HDAC3 O15379 1/20 0.44
MAPK1 P28482 1/20 0.44
ADRA1A P35348 1/20 0.44
HDAC4 P56524 1/20 0.44
SLC6A3 Q01959 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44

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
SCHEMBL343695 1.00 ARG1 (0.60) ARG1ARG2SMN1; SMN2HIF1AMEN1
SCHEMBL29278348 1.00 ARG1 (0.60) ARG1ARG2SMN1; SMN2HIF1AMEN1
SCHEMBL7902168 0.88 ARG1 (0.59) ARG1ARG2SMN1; SMN2HIF1AMEN1
SCHEMBL1819025 0.86 BLM (0.56) ARG1ARG2SMN1; SMN2HIF1AMEN1
SCHEMBL22689266 0.85 ARG1 (0.79) ARG1ARG2SMN1; SMN2HIF1ASLC6A2
SCHEMBL8351006 0.85 SMN1; SMN2 (0.69) ARG1ARG2SMN1; SMN2HIF1ACYP1A2
SCHEMBL7653153 0.84 ARG1 (0.62) ARG1ARG2SMN1; SMN2HIF1AALDH1A1
SCHEMBL14478223 0.82 ARG1 (0.60) ARG1ARG2SMN1; SMN2HIF1AMEN1
SCHEMBL27469449 0.82 ARG1 (0.60) ARG1ARG2SMN1; SMN2HIF1AMEN1
SCHEMBL11265744 0.81 HIF1A (0.60) ARG1ARG2SMN1; SMN2HIF1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6766071-B2 Device and method for the measurement of the heat of a reaction AMERSHAM BIOSCIENCES UK LTD. (GB) 2004-07-20 US claimed
US-20030095735-A1 Device and method for the measurement of the heat of a reaction GE HEALTHCARE UK LIMITED (GB) 2003-05-22 US claimed
US-20220071917-A9 DRUG DELIVERY SYSTEMS AND METHODS COMPRISING POLYSIALIC ACID AND/OR OTHER POLYMERS UNIVERSIDADE DE SANTIAGO DE COMPOSTELA (ES) 2022-03-10 US disclosed
EP-2486229-B1 APPARATUSES AND METHODS OF MANUFACTURING OILFIELD MACHINES MI LLC (US) 2021-09-29 EP disclosed
US-20210228494-A1 DRUG DELIVERY SYSTEMS AND METHODS COMPRISING POLYSIALIC ACID AND/OR OTHER POLYMERS UNIVERSIDADE DE SANTIAGO DE COMPOSTELA (ES) 2021-07-29 US disclosed
EP-3703666-A1 DRUG DELIVERY SYSTEMS AND METHODS COMPRISING POLYSIALIC ACID AND/OR OTHER POLYMERS Universidade de Santiago de Compostela (ES) 2020-09-09 EP disclosed
US-20120245014-A1 APPARATUSES AND METHODS OF MANUFACTURING OILFIELD MACHINES M-I L.L.C. 2012-09-27 US disclosed
EP-2486229-A2 APPARATUSES AND METHODS OF MANUFACTURING OILFIELD MACHINES M.I L.L, C. (US) 2012-08-15 EP disclosed
WO-2011044227-A2 APPARATUSES AND METHODS OF MANUFACTURING OILFIELD MACHINES M-I L.L.C. (US) 2011-04-14 WO disclosed
WO-2011026111-A1 ORAL DELIVERY OF A VACCINE TO THE LARGE INTESTINE TO INDUCE MUCOSAL IMMUNITY THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-03-03 WO disclosed
US-6766071-B2 Device and method for the measurement of the heat of a reaction AMERSHAM BIOSCIENCES UK LTD. (GB) 2004-07-20 US disclosed
US-20030095735-A1 Device and method for the measurement of the heat of a reaction GE HEALTHCARE UK LIMITED (GB) 2003-05-22 US disclosed
US-6277880-B1 ANTIBODY DIRECTED ENZYME PRODUG THERAPY ZENECA LIMITED (GB) 2001-08-21 US disclosed
EP-0651740-B1 AMINO ACID LINKED NITROGEN MUSTARD DERIVATIVES AND THEIR USE AS PRODRUGS IN THE TREATMENT OF TUMOURS ZENECA LTD (GB) 1998-10-21 EP disclosed
US-5714148-A PRODRUGS WHICH ARE SUBSTRATES FOR CARBOXYPEPTIDASE G2 AND YIELD ACTIVE CYTOTOXIC DRUGS ZENECA LIMITED (GB) 1998-02-03 US disclosed
US-5660829-A DEESTERIFYING COMPOUND TO FORM N-(4(N,N-BIS(2-CHLOROETHYL) AMINO)PHENOXYCARBONYL)-L-GLUTAMIC ACID-GAMMA-(3,5-DICARBOXY)ANILIDE ZENECA LIMITED (GB) 1997-08-26 US disclosed
US-5587161-A TWO COMPONENT SYSTEM INCLUDING ANTIBODY OR ANTIGEN BINDING FRAGMENT CONJUGATED TO CARBOXYPEPTIDASE G ENZYME, COMPOUND CONVERTIBLE TO CYTOTOXIC DRUG UNDER INFLUENCE OF ENZYME ZENECA LIMITED (GB) 1996-12-24 US disclosed
EP-0651740-A1 AMINO ACID LINKED NITROGEN MUSTARD DERIVATIVES AND THEIR USE AS PRODRUGS IN THE TREATMENT OF TUMOURS ZENECA LIMITED (GB) 1995-05-10 EP disclosed
US-5405990-A For use in antibody directed enzyme prodrug therapy; cytotoxic parent nitrogen mustard; antitumor agents ZENECA LIMITED (GB) 1995-04-11 US disclosed
WO-1994002450-A1 AMINO ACID LINKED NITROGEN MUSTARD DERIVATIVES AND THEIR USE AS PRODRUGS IN THE TREATMENT OF TUMOURS ZENECA LIMITED (GB) 1994-02-03 WO 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 (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-20210228494-A1 DRUG DELIVERY SYSTEMS AND METHODS COMPRISING POLYSIALIC ACID AND/OR OTHER POLYMERS LNPEP, CLIC1, CLSPN ARG1 587/4885ARG2 2005/4885SMN1; SMN2 2935/4885
US-20220071917-A9 DRUG DELIVERY SYSTEMS AND METHODS COMPRISING POLYSIALIC ACID AND/OR OTHER POLYMERS LNPEP, CLIC1, CLSPN ARG1 587/4885ARG2 2005/4885SMN1; SMN2 2935/4885

“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.