SCHEMBL22221997

SCHEMBL22221997

c1ccc2c(c1)OC(c1ccc3c(c1)SCC(c1ccc4c(c1)SCCO4)S3)O2

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 4/20 0.38
WNT3A P56704 4/20 0.38
SLC5A2 P31639 1/20 0.35
STING1 Q86WV6 1/20 0.32

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
SCHEMBL19492456 0.95 CTNNB1 (0.38) CTNNB1WNT3ASLC5A2STING1
SCHEMBL20758652 0.89 CTNNB1 (0.32) CTNNB1WNT3ASTING1
SCHEMBL22221839 0.86 CTNNB1 (0.43) CTNNB1WNT3ASLC5A2STING1
SCHEMBL21787565 0.74 SLC5A2 (0.36) CTNNB1WNT3ASLC5A2
SCHEMBL18839045 0.73 LTA4H (0.46) CTNNB1WNT3A
SCHEMBL19492439 0.69 FAAH (0.32)
SCHEMBL20662320 0.69 NISCH (0.32)
SCHEMBL19155319 0.68 LTA4H (0.43)
SCHEMBL255962 0.67 ITGB2 (0.52) CTNNB1WNT3A
SCHEMBL29395580 0.67 ITGB2 (0.52) CTNNB1WNT3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11077046-B2 Gamma-diketones for treatment and prevention of aging skin and wrinkles BIOSPLICE THERAPEUTICS, INC. (US) 2021-08-03 US disclosed
US-20200222295-A1 GAMMA-DIKETONES FOR TREATMENT AND PREVENTION OF AGING SKIN AND WRINKLES MED-PATHWAYS II LIMITED (VG) 2020-07-16 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 (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-11077046-B2 Gamma-diketones for treatment and prevention of aging skin and wrinkles GLA, DGKG, DGKA CTNNB1 1789/4885WNT3A 1618/4885SLC5A2 3785/4885
US-20200222295-A1 GAMMA-DIKETONES FOR TREATMENT AND PREVENTION OF AGING SKIN AND WRINKLES GLA, DGKG, DGKA CTNNB1 1789/4885WNT3A 1618/4885SLC5A2 3785/4885

“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.