SCHEMBL3207912

SCHEMBL3207912

CC(=O)c1ccc(-c2cc(C(=O)O)ccc2Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.55
PRKAB2 O43741 1/20 0.52
PRKAG1 P54619 1/20 0.52
PRKAA2 P54646 1/20 0.52
PRKAA1 Q13131 1/20 0.52
PRKAG3 Q9UGI9 1/20 0.52
PRKAG2 Q9UGJ0 1/20 0.52
PRKAB1 Q9Y478 1/20 0.52
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
SRD5A2 P31213 3/20 0.49
EIF4E P06730 2/20 0.48
HSD17B1 P14061 2/20 0.47
ALDH1A1 P00352 1/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
KMO O15229 1/20 0.44
TTR P02766 1/20 0.44
MAPK14 Q16539 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43

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
SCHEMBL6254017 0.91 TSHR (0.61) TSHRMAPTSRD5A2ALDH1A1RXRA
SCHEMBL3220340 0.86 TSHR (0.55) TSHRMAPTSRD5A2HSD17B1ALDH1A1
SCHEMBL3205630 0.86 TSHR (0.55) TSHRPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL15332194 0.85 RXRA (0.51) TSHRMAPTSMN1; SMN2EIF4ERXRA
SCHEMBL3200062 0.85 TSHR (0.59) TSHRPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL3203802 0.84 TSHR (0.53) TSHRMAPTSRD5A2ALDH1A1RXRA
SCHEMBL3199834 0.84 TSHR (0.53) TSHRMAPTSRD5A2HSD17B1ALDH1A1
SCHEMBL2744939 0.83 NPC1 (0.49) TSHRMAPTSMN1; SMN2SRD5A2ALDH1A1
SCHEMBL2427192 0.83 CA1 (0.58) TSHRPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL3218450 0.83 PRKAB2 (0.52) TSHRPRKAB2PRKAG1PRKAA2PRKAA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
US-7683097-B2 Topoisomerase inhibitors Propharmacon Inc. (US) 2010-03-23 US disclosed
US-20070004701-A1 Topoisomerase inhibitors PROPHARMACON, INC. (US) 2007-01-04 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 (1 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-20070004701-A1 Topoisomerase inhibitors TOP1, TOP2A, TOP2B TSHR 4456/4885PRKAB2 1961/4885PRKAG1 1092/4885

“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.