SCHEMBL485606

SCHEMBL485606

CCOC(=O)C1(NC(=O)c2ccc3ccccc3c2O)CC1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.49
KMT2A Q03164 8/20 0.49
KDM4A O75164 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.49
KDM4C Q9H3R0 1/20 0.49
KDM4E B2RXH2 2/20 0.45
MAPT P10636 2/20 0.45
GAA P10253 2/20 0.45
ALDH1A1 P00352 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
HCRTR1 O43613 1/20 0.44
LDHA P00338 1/20 0.44
POLB P06746 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CXCR5 P32302 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
SCHEMBL485521 0.95 MEN1 (0.47) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL3310224 0.90 CXCR5 (0.53) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL10290187 0.89 KMT2A (0.49) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL485604 0.84 CXCR2 (0.51) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL3931108 0.81 KMT2A (0.47) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL485831 0.78 DGAT2 (0.42) MEN1KMT2APOLBCXCR5
SCHEMBL485747 0.78 KDM4E (0.46) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL3308338 0.77 CXCR5 (0.67) MEN1KMT2AKDM4EALDH1A1CXCR5
SCHEMBL3928680 0.77 KMT2A (0.43) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL1740344 0.76 SMN1; SMN2 (0.50) MEN1KMT2AKDM4EGAAALDH1A1

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-8283479-B2 CXCR2 inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2012-10-09 US disclosed
EP-1836158-B1 FUSED BICYCLIC CARBOXAMIDE DERIVATIVES FOR USE AS CXCR2 INHIBITORS IN THE TREATMENT OF INFLAMMATION SANOFI AVENTIS DEUTSCHLAND (DE) 2012-02-01 EP disclosed
US-20110184177-A1 CXCR2 INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-07-28 US disclosed
US-7919628-B2 2-[(1-Benzyloxy-naphthalene-2-carbonyl)-amino]-2-methyl-propionic acid; inhibitors of chemokine receptors; treatment or prophylaxis of acute and chronic inflammatory diseases such as atherosclerosis, ischemic or reperfusion injuries, chronic obstructive pulmonary disease, asthma, rheumatoid arthritis SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-04-05 US disclosed
US-20080090854-A1 CXCR2 INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-04-17 US disclosed
EP-1836158-A1 FUSED BICYCLIC CARBOXAMIDE DERIVATIVES FOR USE AS CXCR2 INHIBITORS IN THE TREATMENT OF INFLAMMATION Sanofi-Aventis Deutschland GmbH (DE) 2007-09-26 EP disclosed
WO-2006069656-A1 FUSED BICYCLIC CARBOXAMIDE DERIVATIVES FOR USE AS CXCR2 INHIBITORS IN THE TREATMENT OF INFLAMMATION SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-07-06 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-20110184177-A1 CXCR2 INHIBITORS CXCR2, CXCR1, CXCR4 MEN1 4049/4885KMT2A 4415/4885KDM4A 3415/4885
US-20080090854-A1 CXCR2 INHIBITORS CXCR2, CXCR1, CXCR4 MEN1 4049/4885KMT2A 4415/4885KDM4A 3415/4885

“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.