SCHEMBL1760907

SCHEMBL1760907

COc1ccc(CN[C@@H](CS)C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.53
ACE P12821 2/20 0.52
NPC1 O15118 3/20 0.48
RAB9A P51151 2/20 0.48
PPARG P37231 1/20 0.46
FFAR1 O14842 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ATM Q13315 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HDAC8 Q9BY41 1/20 0.46

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
SCHEMBL1927881 1.00 LDHA (0.53) LDHAACENPC1RAB9APPARG
SCHEMBL1760820 1.00 LDHA (0.53) LDHAACENPC1RAB9APPARG
SCHEMBL1177136 0.86 PDCD1 (0.56) LDHANPC1RAB9APPARGFFAR1
SCHEMBL1177223 0.86 PDCD1 (0.56) LDHANPC1RAB9APPARGFFAR1
SCHEMBL1097490 0.86 LDHA (0.63) LDHANPC1RAB9APPARGFFAR1
SCHEMBL1177224 0.86 PDCD1 (0.56) LDHANPC1RAB9APPARGFFAR1
SCHEMBL24446771 0.84 ANPEP (0.59) LDHANPC1RAB9AATMALDH1A1
SCHEMBL9543477 0.84 LDHA (0.51) LDHANPC1RAB9APPARGFFAR1
SCHEMBL8948036 0.83 ACE (0.49) ACENPC1RAB9AFFAR1MEN1
SCHEMBL7614779 0.83 ACE (0.49) ACENPC1RAB9AFFAR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023172648-A2 FLUOROGENIC SUBSTRATES FOR AMINOPEPTIDASE DETECTION IN BIOFLUIDS GLYMPSE BIO, INC. (US) 2023-09-14 WO disclosed
EP-1763509-B1 ALPHA-HELICAL MIMETICS WALTER & ELIZA HALL INST MEDICAL RES (AU) 2018-02-21 EP disclosed
US-8039465-B2 Cytoskeletal active compounds, composition and use INSPIRE PHARMACEUTICALS, INC. (US) 2011-10-18 US disclosed
US-8039465-B2 Cytoskeletal active compounds, composition and use INSPIRE PHARMACEUTICALS, INC. (US) 2011-10-18 US disclosed
US-7956216-B2 Benzoyl urea derivatives mimicing BH3-only proteins, able to interact with a Bcl-2 protein THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2011-06-07 US disclosed
US-7947850-B2 Process for the preparation of 3,4-disubstituted-thiazolidin-2-ones INSPIRE PHARMACEUTICALS, INC. (US) 2011-05-24 US disclosed
US-7947850-B2 Process for the preparation of 3,4-disubstituted-thiazolidin-2-ones INSPIRE PHARMACEUTICALS, INC. (US) 2011-05-24 US disclosed
US-20100130572-A1 CYTOSKELETAL ACTIVE COMPOUNDS, COMPOSITION AND USE LAMPE JOHN W 2010-05-27 US disclosed
US-20100130572-A1 CYTOSKELETAL ACTIVE COMPOUNDS, COMPOSITION AND USE LAMPE JOHN W 2010-05-27 US disclosed
US-7666861-B2 Cytoskeletal active compounds, composition and use INSPIRE PHARMACEUTICALS, INC. (US) 2010-02-23 US disclosed
EP-1763509-A1 ALPHA-HELICAL MIMETICS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2007-03-21 EP disclosed
WO-2006104897-A2 CYTOSKELETAL ACTIVE COMPOUNDS, COMPOSITION AND USE INSPIRE PHARMACEUTICALS, INC. (US) 2006-10-05 WO disclosed
US-20060217427-A1 Cytoskeletal active compounds, compositions and use INSPIRE PHARMACEUTICALS, INC. 2006-09-28 US disclosed
WO-2006002474-A1 ALPHA-HELICAL MIMETICS THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2006-01-12 WO disclosed
EP-0444068-A1 TRIALKYSILYL ESTERS OF AMINO ACIDS AND THEIR USE IN THE SYNTHESIS OF PEPTIDES PUBLIC HEALTH LABORATORY SERVICE BOARD (GB) 1991-09-04 EP disclosed
WO-1990005738-A1 TRIALKYSILYL ESTERS OF AMINO ACIDS AND THEIR USE IN THE SYNTHESIS OF PEPTIDES PUBLIC HEALTH LABORATORY SERVICE BOARD (GB) 1990-05-31 WO disclosed
US-4497731-A HORMONES ARMOUR PHARMACEUTICAL COMPANY (US) 1985-02-05 US disclosed
US-4412988-A INFLUENCE OF MEMORY ROUSSEL UCLAF (FR) 1983-11-01 US disclosed
US-4239680-A CALCITONIN ACITIVITY ARMOUR AND COMPANY (US) 1980-12-16 US disclosed
US-4113714-A GROWTH HORMONE RELEASE INHIBITING UNDECAPEPTIDE AMERICAN HOME PRODUCTS CORPORATION (US) 1978-09-12 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 (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-20060217427-A1 Cytoskeletal active compounds, compositions and use RHOA, ACTB, ROCK1 LDHA 2736/4885ACE 1744/4885NPC1 2448/4885
US-20100130572-A1 CYTOSKELETAL ACTIVE COMPOUNDS, COMPOSITION AND USE RHOA, ACTB, ROCK1 LDHA 2817/4885ACE 1852/4885NPC1 2450/4885

“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.