SCHEMBL23163730

SCHEMBL23163730

COC(=O)C1(c2ccc(OC)cc2)CCOCC1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
POLB P06746 4/20 0.61
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
CYP2C19 P33261 2/20 0.57
CYP3A4 P08684 1/20 0.57
HPGD P15428 1/20 0.55
CYP2C9 P11712 1/20 0.55
MAPT P10636 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
MMP1 P03956 1/20 0.47
MMP13 P45452 1/20 0.47
LMNA P02545 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
SCHEMBL837139 0.89 ALDH1A1 (0.55) ALDH1A1POLBMEN1KMT2ACYP2C19
SCHEMBL16897444 0.86 CYP2C19 (0.57) ALDH1A1POLBMEN1KMT2ACYP2C19
SCHEMBL1466916 0.86 POLB (0.62) ALDH1A1POLBMEN1KMT2ACYP2C19
SCHEMBL23164033 0.86 ALDH1A1 (0.47) ALDH1A1POLBMEN1KMT2ACYP2C19
SCHEMBL31525688 0.86 ALDH1A1 (0.60) ALDH1A1POLBMEN1KMT2ACYP2C19
SCHEMBL8586765 0.85 KDM4E (0.58) ALDH1A1MEN1KMT2ACYP2C19CYP3A4
SCHEMBL2701584 0.84 ALDH1A1 (0.59) ALDH1A1POLBMEN1KMT2ACYP2C19
SCHEMBL3904681 0.84 HDAC1 (0.52) ALDH1A1POLBMEN1KMT2ACYP2C19
SCHEMBL16477203 0.84 ALDH1A1 (0.46) ALDH1A1POLBMEN1KMT2ACYP2C19
SCHEMBL1121038 0.84 HDAC1 (0.53) ALDH1A1POLBMEN1KMT2ACYP2C19

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 7 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
CN-117980293-A Hydroxamic acid compound with ENPP1 inhibitory activity and application thereof 上海海和药物研究开发股份有限公司 2024-05-03 CN 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 ALDH1A1 687/4885POLB 2895/4885MEN1 3795/4885
US-20220378772-A1 PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER1, PTGER2 ALDH1A1 950/4885POLB 2958/4885MEN1 3666/4885

“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.