SCHEMBL4889378

SCHEMBL4889378

O=C(O)c1cccc(-c2ncccc2-c2cccc(Cl)c2OCc2ccccc2)c1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 12/20 0.71
CYP2C9 P11712 3/20 0.53
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
MITF O75030 1/20 0.50
TP53 P04637 1/20 0.50
HPGD P15428 1/20 0.50
XBP1 P17861 1/20 0.50
NFKB1 P19838 1/20 0.50
RAB9A P51151 1/20 0.50
NFKB2 Q00653 1/20 0.50
KMT2A Q03164 1/20 0.50
RELA Q04206 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP3A4 P08684 1/20 0.49
MRGPRX4 Q96LA9 5/20 0.46
NR4A2 P43354 1/20 0.46
FABP4 P15090 1/20 0.46
TBXA2R P21731 1/20 0.46

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
SCHEMBL4883485 0.83 PTGER1 (1.00) PTGER1CYP2C9CYP3A4TBXA2R
SCHEMBL4883048 0.83 PTGER1 (0.71) PTGER1CYP2C9MEN1NPC1MITF
SCHEMBL4886678 0.83 PTGER1 (0.71) PTGER1CYP2C9MEN1NPC1MITF
SCHEMBL22480969 0.75 NPC1 (0.74) MEN1NPC1MITFTP53HPGD
SCHEMBL4879744 0.74 PTGER1 (1.00) PTGER1CYP2C9CYP3A4MRGPRX4TBXA2R
SCHEMBL4880247 0.73 PTGER1 (0.79) PTGER1CYP2C9CYP3A4TBXA2R
SCHEMBL30008028 0.72 PTGER1 (0.65) PTGER1CYP2C9MEN1KMT2ACYP3A4
SCHEMBL5103404 0.72 PTGER1 (0.69) PTGER1CYP2C9MEN1NPC1MITF
SCHEMBL28619006 0.71 MRGPRX4 (0.52) PTGER1CYP2C9MEN1NPC1MITF
SCHEMBL5157932 0.70 PTGER1 (0.69) PTGER1CYP2C9CYP3A4MRGPRX4NR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275053-A1 Selective modulators of prostaglandin E2 at EP1 receptors; analgesics, antiinflammatory agents; neurodegenerative diseases, bone or renal disorders; 3-{1-[2-(benzyloxy)-phenyl]-5-methyl-1H-pyrrol-2-yl}-benzoic acid GLAXOSMITHKLINE 2008-11-06 US 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-20080275053-A1 Selective modulators of prostaglandin E2 at EP1 receptors; analgesics, antiinflammatory agents; neurodegenerative diseases, bone or renal disorders; 3-{1-[2-(benzyloxy)-phenyl]-5-methyl-1H-pyrrol-2-yl}-benzoic acid PTGER1, PTGER2, PTGDR PTGER1 1/4885CYP2C9 820/4885MEN1 3594/4885

“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.