SCHEMBL23164208

SCHEMBL23164208

COC(=O)c1ccc([C@H](C)NC(=O)C2(c3cccc(OCc4ccccc4)c3)CCOCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 6/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ ACACB O00763 1/20 0.47
▸ TP53 P04637 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.44
▸ CHRM3 P20309 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ F7 P08709 1/20 0.42
▸ ADAM17 P78536 1/20 0.42
▸ MRGPRX4 Q96LA9 1/20 0.42
▸ ACACA Q13085 1/20 0.42

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
SCHEMBL23164209 1.00 ALOX5 (0.47) ALOX5ALDH1A1ACACBTP53HTT
SCHEMBL23164192 0.93 ALDH1A1 (0.48) ALOX5ALDH1A1ACACBTP53HTT
SCHEMBL29705715 0.93 ALDH1A1 (0.48) ALOX5ALDH1A1ACACBTP53HTT
SCHEMBL23164193 0.93 ALDH1A1 (0.48) ALOX5ALDH1A1ACACBTP53HTT
SCHEMBL23163484 0.92 ACACB (0.48) ACACBNPSR1CHRM3MEN1KMT2A
SCHEMBL23163486 0.92 ACACB (0.48) ACACBNPSR1CHRM3MEN1KMT2A
SCHEMBL27078197 0.90 ALDH1A1 (0.49) ALOX5ALDH1A1ACACBTP53HTT
SCHEMBL27078201 0.90 ALDH1A1 (0.49) ALOX5ALDH1A1ACACBTP53HTT
SCHEMBL29731124 0.87 ALDH1A1 (0.43) ALOX5ALDH1A1ACACBTP53HTT
SCHEMBL27077970 0.87 ALDH1A1 (0.43) ALOX5ALDH1A1ACACBTP53HTT

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-12527779-B2 Prostaglandin E2 (PGE2) EP4 receptor antagonists DOMAIN THERAPEUTICS (FR) 2026-01-20 — — US disclosed
EP-4038052-B1 PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS DOMAIN THERAPEUTICS (FR) 2024-02-07 — — EP disclosed
US-20220378772-A1 PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS DOMAIN THERAPEUTICS (FR) 2022-12-01 — — US disclosed
EP-4038052-A2 PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS Domain Therapeutics (FR) 2022-08-10 — — EP disclosed
CN-114555573-A Prostaglandin E2(PGE2)EP4Receptor antagonists 多曼治疗学公司 2022-05-27 — — CN disclosed
WO-2021064189-A2 PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS DOMAIN THERAPEUTICS (FR) 2021-04-08 — — 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-12527779-B2 Prostaglandin E2 (PGE2) EP4 receptor antagonists PTGER1, PTGER4, PTGER3 ALOX5 33/4885ALDH1A1 687/4885ACACB 1718/4885
US-20220378772-A1 PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER1, PTGER2 ALOX5 22/4885ALDH1A1 950/4885ACACB 2579/4885

“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.

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