SCHEMBL1625354

SCHEMBL1625354

CCOC(=O)Cc1cccc(Cl)c1I

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 3/20 0.48
PKM P14618 1/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 2/20 0.43
CYP2C9 P11712 2/20 0.43
LMNA P02545 2/20 0.43
KMT2A Q03164 2/20 0.43
USP2 O75604 1/20 0.43
TTR P02766 1/20 0.43
TBXA2R P21731 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
P2RX7 Q99572 1/20 0.42
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL29965785 0.85 NLRP3 (0.51) NLRP3PKMHTTALDH1A1CYP2C9
SCHEMBL705708 0.85 NLRP3 (0.51) NLRP3PKMHTTALDH1A1CYP2C9
SCHEMBL513530 0.83 PKM (0.53) NLRP3PKMALDH1A1CYP2C9LMNA
SCHEMBL18169344 0.83 NLRP3 (0.49) NLRP3PKMHTTALDH1A1CYP2C9
SCHEMBL1625750 0.81 NLRP3 (0.48) NLRP3PKMALDH1A1KMT2ACYP4F2
SCHEMBL7563081 0.81 CHEK1 (0.49) NLRP3PKMALDH1A1KMT2ACYP4F2
SCHEMBL1626000 0.81 NLRP3 (0.48) NLRP3PKMHTTALDH1A1CYP2C9
SCHEMBL31075841 0.80 NLRP3 (0.47) NLRP3PKMHTTALDH1A1CYP2C9
SCHEMBL11423081 0.80 NLRP3 (0.44) NLRP3PKMHTTALDH1A1CYP2C9
SCHEMBL1429298 0.78 AKR1B1 (0.55) NLRP3HTTALDH1A1CYP2C9LMNA

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-7928139-B2 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof AMGEN INC. (US) 2011-04-19 US disclosed
US-20100048572-A1 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF AMGEN INC. (US) 2010-02-25 US disclosed
US-7635715-B2 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof AMGEN INC. (US) 2009-12-22 US disclosed
EP-2111399-A2 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF Amgen Inc. (US) 2009-10-28 EP disclosed
US-20090093483-A1 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof AMGEN INC. (US) 2009-04-09 US disclosed
WO-2008076427-A2 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF AMGEN INC. (US) 2008-06-26 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-20100048572-A1 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF EGLN2, EGLN3, HIF1AN NLRP3 3223/4885PKM 908/4885HTT 2689/4885
US-20090093483-A1 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof EGLN2, EGLN3, HIF1AN NLRP3 3223/4885PKM 908/4885HTT 2689/4885

“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.