SCHEMBL7246696

SCHEMBL7246696

O=c1c2ccccc2oc2c1sc1ccccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 2/20 0.71
▸ ESR1 P03372 1/20 0.59
▸ MAOA P21397 9/20 0.52
▸ KDM4E B2RXH2 3/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ GLA P06280 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ PGAM1 P18669 1/20 0.52
▸ CASP1 P29466 1/20 0.52
▸ CASP7 P55210 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ KDM5A P29375 1/20 0.46
▸ PTGS2 P35354 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ NTRK1 P04629 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
SCHEMBL15101937 0.85 ESR2 (0.53) ESR2ESR1MAOAKDM4EALDH1A1
SCHEMBL29923014 0.85 ESR2 (0.53) ESR2ESR1MAOAKDM4EALDH1A1
SCHEMBL7228032 0.84 ESR2 (1.00) ESR2ESR1MAOAKDM4EALDH1A1
SCHEMBL7227909 0.80 ESR2 (0.67) ESR2ESR1MAOAKDM4EALDH1A1
Xanthone SCHEMBL9175420 0.78 MAOA (0.72) MAOAKDM4EALDH1A1GLACYP3A4
SCHEMBL17689908 0.77 ESR2 (0.49) ESR2ESR1MAOAKDM4EALDH1A1
SCHEMBL7228385 0.75 ESR2 (1.00) ESR2ESR1MAOACYP3A4MAPT
SCHEMBL19419237 0.74 ESR2 (0.46) ESR2ESR1MAOAKDM4EALDH1A1
SCHEMBL24071854 0.73 ESR2 (0.47) ESR2ESR1MAPTSMN1; SMN2RAB9A
SCHEMBL22012012 0.72 ESR2 (0.43) ESR2ESR1MAOAKDM4EALDH1A1

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
CN-104725399-B Method for using ionic liquid to promote intramolecular cross dehydrogenation coupling so as to synthesize benzothieno[3,2-b]chromone compounds 新疆大学 2017-05-24 — — CN disclosed
CN-104725399-B Method for using ionic liquid to promote intramolecular cross dehydrogenation coupling so as to synthesize benzothieno[3,2-b]chromone compounds 新疆大学 2017-05-24 — — CN disclosed
CN-104725399-A Method for using ionic liquid to promote intramolecular cross dehydrogenation coupling so as to synthesize benzothieno[3,2-b]chromone compounds UNIV XINJIANG 2015-06-24 — — CN disclosed
CN-104725399-A Method for using ionic liquid to promote intramolecular cross dehydrogenation coupling so as to synthesize benzothieno[3,2-b]chromone compounds UNIV XINJIANG 2015-06-24 — — CN disclosed
US-6559177-B2 For therapy or inhibiting osteoporosis or inhibiting bone demineralization, inflammatory bowel disease, Crohn's disease, ulcerative proctitis, or colitis in mammal WYETH 2003-05-06 — — US disclosed
US-6559177-B2 For therapy or inhibiting osteoporosis or inhibiting bone demineralization, inflammatory bowel disease, Crohn's disease, ulcerative proctitis, or colitis in mammal WYETH 2003-05-06 — — US disclosed
US-20020183310-A1 5,11-dioxa-benzo[b]fluoren-10-one and 5-oxa-11-thia-benzo[b]fluoren-10-ones as estrogenic agents WYETH 2002-12-05 — — US disclosed
US-20020183310-A1 5,11-dioxa-benzo[b]fluoren-10-one and 5-oxa-11-thia-benzo[b]fluoren-10-ones as estrogenic agents WYETH 2002-12-05 — — 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-20020183310-A1 5,11-dioxa-benzo[b]fluoren-10-one and 5-oxa-11-thia-benzo[b]fluoren-10-ones as estrogenic agents ESR1, GPER1, ESR2 ESR2 3/4885ESR1 1/4885MAOA 716/4885

“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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