SCHEMBL1627769

SCHEMBL1627769

CCOC(=O)C(C(=O)OCC)C(=O)C1(c2ccc(Cl)c(Cl)c2)CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.52
HDAC1 Q13547 1/20 0.46
CHRM2 P08172 3/20 0.44
CHRM1 P11229 3/20 0.44
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
P2RX7 Q99572 1/20 0.40
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL1627224 0.90 OPRM1 (0.42) OPRM1HDAC1CHRM2CHRM1SLC6A2
SCHEMBL1627528 0.86 OPRM1 (0.49) OPRM1P2RX7TSHRSMN1; SMN2POLB
SCHEMBL1627624 0.85 NPSR1 (0.43) P2RX7TSHRSMN1; SMN2POLBCYP2C9
SCHEMBL1625665 0.83 CYP2C19 (0.39) OPRM1P2RX7TSHRPOLBCYP2C9
SCHEMBL1626981 0.81 OPRM1 (0.49) OPRM1TSHRPOLBCYP2C9CYP2C19
SCHEMBL1626437 0.81 NPSR1 (0.56) OPRM1SLC6A4TSHRCYP2C9CYP2C19
SCHEMBL1625633 0.81 POLB (0.58) SMN1; SMN2POLBCYP2C9CYP2C19
SCHEMBL1625746 0.80 LMNA (0.44) OPRM1HDAC1TSHRSMN1; SMN2POLB
SCHEMBL1626285 0.80 KMT2A (0.41) HDAC1POLBCYP2C9CYP2C19
SCHEMBL1626548 0.80 OPRM1 (0.47) OPRM1CHRM2CHRM1P2RX7SMN1; SMN2

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 OPRM1 3044/4885HDAC1 161/4885CHRM2 4881/4885
US-20090093483-A1 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof EGLN2, EGLN3, HIF1AN OPRM1 3044/4885HDAC1 161/4885CHRM2 4881/4885

“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.