SCHEMBL186474

SCHEMBL186474

CCCNc1ccc(C(=O)O)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 18/20 1.00
HCAR2 Q8TDS4 2/20 0.65
FYN P06241 1/20 0.56
MAPT P10636 1/20 0.50

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
SCHEMBL22047713 0.90 HCAR3 (1.00) HCAR3HCAR2FYN
SCHEMBL11246840 0.88 HCAR3 (0.97) HCAR3HCAR2
Hydrochloric Acid SCHEMBL11180843 0.86 HCAR3 (0.94) HCAR3HCAR2
SCHEMBL186420 0.86 HCAR3 (1.00) HCAR3HCAR2MAPT
SCHEMBL18193683 0.85 HCAR3 (0.74) HCAR3HCAR2
SCHEMBL7230169 0.85 HCAR3 (0.73) HCAR3HCAR2
SCHEMBL3562313 0.83 HCAR3 (0.71) HCAR3HCAR2
SCHEMBL31058294 0.83 HCAR3 (0.71) HCAR3HCAR2
SCHEMBL2128183 0.83 HCAR3 (1.00) HCAR3HCAR2
SCHEMBL13610833 0.83 HCAR3 (0.70) HCAR3HCAR2FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200055825-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas, Inc. 2020-02-20 US disclosed
US-20130131075-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-05-23 US disclosed
EP-2401256-B1 Compounds as bradykinin B1 antagonists BOEHRINGER INGELHEIM INT (DE) 2013-04-17 EP disclosed
EP-2401256-A1 COMPOUNDS AS BRADYKININ B1 ANTAGONISTS Boehringer Ingelheim International GmbH (DE) 2012-01-04 EP disclosed
US-20100240669-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-23 US disclosed
WO-2010097372-A1 COMPOUNDS AS BRADYKININ B1 ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 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 (3 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-20200055825-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, MDM2, ESRRA HCAR3 467/4885HCAR2 447/4885FYN 2639/4885
US-20130131075-A1 NEW COMPOUNDS ADORA1, H1-10, P2RY11 HCAR3 302/4885HCAR2 1304/4885FYN 2615/4885
US-20100240669-A1 NEW COMPOUNDS ADORA1, H1-10, P2RY11 HCAR3 302/4885HCAR2 1304/4885FYN 2615/4885

“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.