SCHEMBL20487669

SCHEMBL20487669

CC1(C)Cc2ccsc2C2(CCN(C(=O)O)CC2)O1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 8/20 0.39
DRD2 P14416 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
OPRM1 P35372 2/20 0.33

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
SCHEMBL20488362 0.83 USP2 (0.40)
SCHEMBL20487513 0.78 RORA (0.35) DRD2SIGMAR1
SCHEMBL1807709 0.77 OPRL1 (0.53) OPRL1SIGMAR1
SCHEMBL21681635 0.76 OPRL1 (0.38) OPRL1
SCHEMBL18579749 0.76 OPRL1 (0.38) OPRL1
SCHEMBL20487426 0.75 TAAR1 (0.35) SIGMAR1
SCHEMBL23223306 0.72 USP2 (0.40)
SCHEMBL13560088 0.69 L3MBTL1 (0.38) OPRL1DRD2OPRM1
SCHEMBL21681621 0.68 HHAT (0.36) OPRL1
SCHEMBL21681614 0.68 HHAT (0.36) OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3589637-B1 COMPOUNDS USEFUL FOR INHIBITING ROR-GAMMA-T LILLY CO ELI (US) 2021-04-14 EP disclosed
US-10603320-B2 Compounds useful for inhibiting ROR-gamma-t ELI LILLY AND COMPANY (US) 2020-03-31 US disclosed
WO-2018160547-A1 COMPOUNDS USEFUL FOR INHIBITING ROR-GAMMA-T ELI LILLY AND COMPANY (US) 2018-09-07 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 (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-10603320-B2 Compounds useful for inhibiting ROR-gamma-t RORC, RORB, RORA OPRL1 2163/4885DRD2 4135/4885SIGMAR1 2260/4885

“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.