SCHEMBL845174

SCHEMBL845174

NC=CCc1cccc(CC(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.48
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
GLS O94925 1/20 0.43
ITGB3 P05106 2/20 0.42
ITGA2B P08514 2/20 0.42
LMNA P02545 2/20 0.42
GAA P10253 2/20 0.42
TSHR P16473 2/20 0.42
KDM4E B2RXH2 1/20 0.42
RGS12 O14924 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
NFKB1 P19838 1/20 0.42
APEX1 P27695 1/20 0.42
THPO P40225 1/20 0.42
BLM P54132 1/20 0.42
GNAI1 P63096 1/20 0.42
PMP22 Q01453 1/20 0.42

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
SCHEMBL27936150 0.84 AKR1B1 (0.50) AKR1B1CYP1A2CYP2C19GLSITGB3
SCHEMBL9288720 0.83 MAOB (0.46) LMNAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL27802435 0.83 AKR1B1 (0.48) AKR1B1CYP1A2CYP2C19GLSITGB3
SCHEMBL27802429 0.83 AKR1B1 (0.48) AKR1B1CYP1A2CYP2C19GLSITGB3
SCHEMBL845691 0.82 CA2 (0.52) AKR1B1ITGB3ITGA2BLMNAGAA
SCHEMBL3114737 0.82 AKR1B1 (0.56) AKR1B1CYP1A2CYP2C19GLSITGB3
SCHEMBL70565 0.81 AKR1B1 (0.71) AKR1B1CYP1A2CYP2C19GLSLMNA
Hydrochloric Acid SCHEMBL8922940 0.79 AKR1B1 (0.68) AKR1B1CYP1A2CYP2C19GLSLMNA
SCHEMBL3856726 0.79 AKR1B1 (0.52) AKR1B1CYP1A2CYP2C19GLSLMNA
SCHEMBL21728869 0.76 AKR1B1 (0.58) AKR1B1CYP1A2CYP2C19ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2582715-B1 GROWTH HORMONE SECRETATOGUE RECEPTOR ANTAGONISTS AND USES THEREOF THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2018-11-28 EP claimed
US-9724381-B2 Methods of inhibiting the ghrelin/growth hormone secretatogue receptor pathway and uses thereof THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2017-08-08 US claimed
US-9315546-B2 Growth hormone secretatogue receptor antagonists and uses thereof THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2016-04-19 US claimed
WO-2013142229-A1 DESIGNING NOVEL PEPTIDES FOR INDUCING FIBRONECTIN MATRIX ASSEMBLY PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-09-26 WO claimed
US-20130172242-A1 GROWTH HORMONE SECRETATOGUE RECEPTOR ANTAGONISTS AND USES THEREOF MCGILL UNIVERSITY (CA) 2013-07-04 US claimed
EP-2582715-A2 GROWTH HORMONE SECRETATOGUE RECEPTOR ANTAGONISTS AND USES THEREOF The Administrators of the Tulane Educational Fund (US) 2013-04-24 EP claimed
WO-2011159917-A2 GROWTH HORMONE SECRETATOGUE RECEPTOR ANTAGONISTS AND USES THEREOF THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2011-12-22 WO claimed
WO-2011126882-A2 THERAPEUTIC PEPTIDES AND THEIR DERIVATIVES AND THERAPEUTIC USES THEREOF AMERICAN TYPE CULTURE COLLECTION (US) 2011-10-13 WO claimed
WO-2010132580-A2 METHODS OF INHIBITING THE GHRELIN/GROWTH HORMONE SECRETATOGUE RECEPTOR PATHWAY AND USES THEREOF THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2010-11-18 WO claimed
WO-2024137362-A1 GENERATION OF ALVEOLAR EPITHELIAL TYPE 1 (AT1) CELLS TRUSTEES OF BOSTON UNIVERSITY (US) 2024-06-27 WO disclosed
WO-2024112749-A1 METHODS OF TREATING HEART FAILURE THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2024-05-30 WO disclosed
WO-2024107916-A1 METHODS AND COMPOSITION RELATING TO PARTICLE CAPTURE TRUSTEES OF BOSTON UNIVERSITY (US) 2024-05-23 WO disclosed
US-20240117033-A1 METHODS AND COMPOSITIONS RELATING TO ANTI-MFSD2A ANTIBODIES PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2024-04-11 US disclosed
US-20240108715-A1 2019-NCOV (SARS-COV-2) VACCINE VAXBIO LTD (GB) 2024-04-04 US disclosed
US-20120135918-A1 METHODS OF INHIBITING THE GHRELIN/GROWTH HORMONE SECRETATOGUE RECEPTOR PATHWAY AND USES THEREOF MCGILL UNIVERSITY (CA) 2012-05-31 US disclosed
WO-2012058201-A2 METHOD FOR DETERMINING ACTIVATORS OF EXCITATORY SYNAPSE FORMATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-05-03 WO disclosed
WO-2011159917-A2 GROWTH HORMONE SECRETATOGUE RECEPTOR ANTAGONISTS AND USES THEREOF THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2011-12-22 WO disclosed
US-20110268736-A1 METHOD FOR TREATING CONGENITAL MYOPATHY CHILDREN'S MEDICAL CENTER CORPORATION (US) 2011-11-03 US disclosed
WO-2011126882-A2 THERAPEUTIC PEPTIDES AND THEIR DERIVATIVES AND THERAPEUTIC USES THEREOF AMERICAN TYPE CULTURE COLLECTION (US) 2011-10-13 WO disclosed
WO-2010132580-A2 METHODS OF INHIBITING THE GHRELIN/GROWTH HORMONE SECRETATOGUE RECEPTOR PATHWAY AND USES THEREOF THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 2010-11-18 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-20120135918-A1 METHODS OF INHIBITING THE GHRELIN/GROWTH HORMONE SECRETATOGUE RECEPTOR PATHWAY AND USES THEREOF GHSR, GIPR, GHRHR AKR1B1 561/4885CYP1A2 3570/4885CYP2C19 2788/4885
US-20130172242-A1 GROWTH HORMONE SECRETATOGUE RECEPTOR ANTAGONISTS AND USES THEREOF GHSR, GHRHR, GIPR AKR1B1 1756/4885CYP1A2 2735/4885CYP2C19 3417/4885

“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.