SCHEMBL21982871

SCHEMBL21982871

CC(S)NC[C@H](C)Oc1cc(F)cc(CCC(=O)C(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 1/20 0.37
▸ CYP4A11 Q02928 1/20 0.37
▸ GCK P35557 6/20 0.33
▸ FFAR4 Q5NUL3 2/20 0.33
▸ MTNR1A P48039 8/20 0.32
▸ MTNR1B P49286 8/20 0.32
▸ CNR1 P21554 1/20 0.30
▸ CNR2 P34972 1/20 0.30

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
SCHEMBL20325098 1.00 CYP4F2 (0.37) CYP4F2CYP4A11GCKFFAR4MTNR1A
SCHEMBL18592300 0.92 CYP4F2 (0.38) CYP4F2CYP4A11GCKFFAR4MTNR1A
SCHEMBL22560664 0.92 CYP4F2 (0.38) CYP4F2CYP4A11GCKFFAR4MTNR1A
SCHEMBL18592294 0.92 CYP4F2 (0.38) CYP4F2CYP4A11GCKFFAR4MTNR1A
SCHEMBL20046556 0.89 IAPP (0.35) CYP4F2CYP4A11GCKFFAR4MTNR1A
SCHEMBL20443669 0.89 IAPP (0.35) CYP4F2CYP4A11GCKFFAR4MTNR1A
SCHEMBL20133413 0.88 CYP4F2 (0.39) CYP4F2CYP4A11GCKFFAR4MTNR1A
SCHEMBL26030360 0.88 CYP4F2 (0.39) CYP4F2CYP4A11GCKFFAR4MTNR1A
SCHEMBL21472028 0.87 CYP4F2 (0.38) CYP4F2CYP4A11GCKFFAR4MTNR1A
SCHEMBL20443306 0.87 CYP4F2 (0.38) CYP4F2CYP4A11GCKFFAR4MTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10647698-B2 Tetrahydronaphthalene and tetrahydroisoquinoline derivatives as estrogen receptor degraders ARVINAS OPERATIONS, INC. (US) 2020-05-12 — — 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-10647698-B2 Tetrahydronaphthalene and tetrahydroisoquinoline derivatives as estrogen receptor degraders MDM2, CRBN, VHL CYP4F2 2577/4885CYP4A11 2702/4885GCK 4695/4885

“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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