SCHEMBL758230

SCHEMBL758230

O=Cc1ccc(Oc2cccc(C(=O)O)c2)cc1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.72
KMO O15229 1/20 0.60
KDM4E B2RXH2 1/20 0.60
UNG P13051 1/20 0.59
NPC1 O15118 2/20 0.56
POLB P06746 1/20 0.56
CYP2C9 P11712 1/20 0.56
RAB9A P51151 1/20 0.56
PARP10 Q53GL7 2/20 0.54
PARP3 Q9Y6F1 1/20 0.54
TNKS O95271 1/20 0.53
PARP15 Q460N3 1/20 0.53
PARP14 Q460N5 1/20 0.53
TNKS2 Q9H2K2 1/20 0.53
PARP2 Q9UGN5 1/20 0.53
ALDH1A1 P00352 2/20 0.52
HDAC8 Q9BY41 1/20 0.51
NR1H4 Q96RI1 1/20 0.51
MRGPRX4 Q96LA9 1/20 0.49

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
SCHEMBL3130174 0.89 UNG (0.71) AKR1C3KMOKDM4EUNGNPC1
SCHEMBL1042631 0.88 AKR1C3 (0.92) AKR1C3KMOKDM4ENPC1POLB
SCHEMBL30266789 0.88 AKR1C3 (0.92) AKR1C3KMOKDM4ENPC1POLB
SCHEMBL29546656 0.86 AKR1C3 (0.96) AKR1C3KMOKDM4ENPC1POLB
SCHEMBL4320685 0.86 AKR1C3 (0.96) AKR1C3KMOKDM4ENPC1POLB
SCHEMBL28701196 0.86 AKR1C3 (0.96) AKR1C3KMOKDM4ENPC1POLB
SCHEMBL28313588 0.86 PARP10 (0.73) AKR1C3KDM4EPARP10PARP3TNKS
SCHEMBL70012 0.84 AKR1C3 (0.85) AKR1C3KMOKDM4ENPC1POLB
SCHEMBL16429240 0.84 AKR1C3 (0.85) AKR1C3KMOKDM4ENPC1POLB
SCHEMBL30307447 0.84 AKR1C3 (0.85) AKR1C3KMOKDM4ENPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4314004-B1 CARBOXY SUBSTITUTED GLUCOCORTICOID RECEPTOR AGONISTS LILLY CO ELI (US) 2025-01-22 EP disclosed
US-12162905-B2 Carboxy substituted glucocorticoid receptor agonists ELI LILLY AND COMPANY (US) 2024-12-10 US disclosed
US-20230227493-A1 CARBOXY SUBSTITUTED GLUCOCORTICOID RECEPTOR AGONISTS ELI LILLY AND COMPANY 2023-07-20 US disclosed
US-20230227493-A1 CARBOXY SUBSTITUTED GLUCOCORTICOID RECEPTOR AGONISTS ELI LILLY AND COMPANY 2023-07-20 US disclosed
US-11618767-B2 Carboxy substituted glucocorticoid receptor agonists ELI LILLY AND COMPANY (US) 2023-04-04 US disclosed
US-20220306681-A1 CARBOXY SUBSTITUTED GLUCOCORTICOID RECEPTOR AGONISTS ELI LILLY AND COMPANY 2022-09-29 US disclosed
US-20220306681-A1 CARBOXY SUBSTITUTED GLUCOCORTICOID RECEPTOR AGONISTS ELI LILLY AND COMPANY 2022-09-29 US disclosed
US-8916589-B2 Bradykinin B1-antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-12-23 US disclosed
EP-2188254-B1 NOVEL BRADYKININ B1-ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2012-03-21 EP disclosed
US-20110263626-A1 NOVEL BRADYKININ B1-ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-10-27 US disclosed
EP-2188254-A1 NOVEL BRADYKININ B1-ANTAGONISTS Boehringer Ingelheim International GmbH (DE) 2010-05-26 EP disclosed
WO-2009027450-A1 NOVEL BRADYKININ B1-ANTAGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-03-05 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 (5 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-20230227493-A1 CARBOXY SUBSTITUTED GLUCOCORTICOID RECEPTOR AGONISTS NR3C1, MC2R, NR3C2 AKR1C3 51/4885KMO 798/4885KDM4E 2384/4885
US-20110263626-A1 NOVEL BRADYKININ B1-ANTAGONISTS BDKRB1, BDKRB2, EDNRB AKR1C3 188/4885KMO 752/4885KDM4E 4017/4885
US-20220306681-A1 CARBOXY SUBSTITUTED GLUCOCORTICOID RECEPTOR AGONISTS NR3C1, MC2R, NR3C2 AKR1C3 51/4885KMO 798/4885KDM4E 2384/4885
US-11618767-B2 Carboxy substituted glucocorticoid receptor agonists NR3C1, MC2R, NR3C2 AKR1C3 51/4885KMO 798/4885KDM4E 2384/4885
US-12162905-B2 Carboxy substituted glucocorticoid receptor agonists NR3C1, MC2R, NR3C2 AKR1C3 51/4885KMO 798/4885KDM4E 2384/4885

“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.