SCHEMBL8797209

SCHEMBL8797209

O=C(O)c1cccc(-c2ccccc2)c1OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 6/20 0.55
RXRA P19793 1/20 0.52
RXRB P28702 1/20 0.52
RXRG P48443 1/20 0.52
HNF4A P41235 1/20 0.51
MCL1 Q07820 2/20 0.50
ALDH1A1 P00352 1/20 0.49
CTSV O60911 1/20 0.46
CTSL P07711 1/20 0.46
PTGER4 P35408 1/20 0.46
PTGER3 P43115 1/20 0.46
PTGER2 P43116 1/20 0.46
NR4A2 P43354 2/20 0.45
CHRNB2 P17787 1/20 0.45
CHRNB4 P30926 1/20 0.45
CHRNA3 P32297 1/20 0.45
CHRNA4 P43681 1/20 0.45
BCL2L1 Q07817 1/20 0.45
NR4A1 P22736 1/20 0.45
NR4A3 Q92570 1/20 0.45

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
SCHEMBL5471405 0.94 PTGER1 (0.56) PTGER1RXRARXRBRXRGHNF4A
SCHEMBL1315389 0.90 PTGER1 (0.49) PTGER1RXRARXRBRXRGHNF4A
SCHEMBL1639034 0.88 MAOB (0.50) PTGER1RXRARXRBRXRGALDH1A1
SCHEMBL1667777 0.88 BCAT2 (0.56) PTGER1RXRARXRBRXRGMCL1
SCHEMBL28948616 0.88 PTGER1 (0.49) PTGER1MCL1CTSVCTSLPTGER4
SCHEMBL1315583 0.88 CYP11B1 (0.51) PTGER1ALDH1A1
SCHEMBL15716510 0.87 ALDH1A1 (0.58) PTGER1MCL1ALDH1A1CTSVCTSL
SCHEMBL25431505 0.87 ALDH1A1 (0.56) PTGER1RXRARXRBRXRGALDH1A1
SCHEMBL1638569 0.87 PTGER1 (0.50) PTGER1RXRARXRBRXRGALDH1A1
SCHEMBL7761823 0.86 MEN1 (0.49) PTGER1MCL1ALDH1A1CTSVCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230331720-A1 MEDIUM- OR MACRO-CYCLIC BENZYL-SUBSTITUTED HETEROCYCLE DERIVATIVES AND THEIR USES AS OREXIN-2 RECEPTOR AGONISTS OXFORD FINANCE LLC 2023-10-19 US disclosed
US-20230331720-A1 MEDIUM- OR MACRO-CYCLIC BENZYL-SUBSTITUTED HETEROCYCLE DERIVATIVES AND THEIR USES AS OREXIN-2 RECEPTOR AGONISTS OXFORD FINANCE LLC 2023-10-19 US disclosed
US-20230331720-A1 MEDIUM- OR MACRO-CYCLIC BENZYL-SUBSTITUTED HETEROCYCLE DERIVATIVES AND THEIR USES AS OREXIN-2 RECEPTOR AGONISTS OXFORD FINANCE LLC 2023-10-19 US disclosed
CN-116874428-A PNPO inhibitor with multiple myeloma resisting effect, and preparation method and application thereof 南京中医药大学 2023-10-13 CN disclosed
EP-4208465-A1 MEDIUM- OR MACRO-CYCLIC BENZYL-SUBSTITUTED HETEROCYCLE DERIVATIVES AND THEIR USES AS OREXIN-2 RECEPTOR AGONISTS Orexia Therapeutics Limited (GB) 2023-07-12 EP disclosed
WO-2022051583-A1 MEDIUM- OR MACRO-CYCLIC BENZYL-SUBSTITUTED HETEROCYCLE DERIVATIVES AND THEIR USES AS OREXIN-2 RECEPTOR AGONISTS OREXIA THERAPEUTICS LIMITED (GB) 2022-03-10 WO disclosed
EP-0778821-A1 ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF ZENECA LIMITED (GB) 1997-06-18 EP disclosed
WO-1996006822-A1 ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF ZENECA LIMITED (GB) 1996-03-07 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 (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-20230331720-A1 MEDIUM- OR MACRO-CYCLIC BENZYL-SUBSTITUTED HETEROCYCLE DERIVATIVES AND THEIR USES AS OREXIN-2 RECEPTOR AGONISTS HCRTR2, HCRTR1, CRHR2 PTGER1 1630/4885RXRA 553/4885RXRB 391/4885

“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.