SCHEMBL26816807

SCHEMBL26816807

CC(=O)C(C)(O)c1cc(F)c(-c2cccc(C(C)C)c2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN5 P54829 4/20 0.44
▸ RXRA P19793 2/20 0.43
▸ RXRB P28702 1/20 0.43
▸ RXRG P48443 1/20 0.43
▸ AKR1C3 P42330 4/20 0.38
▸ AKR1C2 P52895 4/20 0.38
▸ KAT6A Q92794 1/20 0.36
▸ PTGS1 P23219 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ PTGS2 P35354 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ FABP2 P12104 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ AKR1C4 P17516 1/20 0.35
▸ ADRA2B P18089 1/20 0.35
▸ CHRM3 P20309 1/20 0.35
▸ HTR2C P28335 1/20 0.35

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
SCHEMBL23380269 0.90 RXRA (0.46) PTPN5RXRARXRBRXRGAKR1C3
SCHEMBL26816802 0.81 RXRA (0.57) PTPN5RXRARXRBRXRGCYP2C9
SCHEMBL26816793 0.79 RXRA (0.51) PTPN5RXRARXRBRXRGAKR1C3
SCHEMBL23380676 0.76 RXRA (0.63) PTPN5RXRARXRBRXRGAKR1C3
SCHEMBL26816804 0.74 PTPN5 (0.41) PTPN5RXRARXRBRXRGAKR1C3
SCHEMBL23380262 0.73 THRA (0.49) PTPN5RXRARXRBRXRGAKR1C3
SCHEMBL23380261 0.71 CNR2 (0.46) PTPN5AKR1C3AKR1C2AKR1C1
SCHEMBL26816794 0.71 RXRA (0.48) PTPN5RXRARXRBRXRGAKR1C3
SCHEMBL25598440 0.70 FFAR1 (0.53) RXRARXRBRXRGPTGS2TSHR
SCHEMBL23380263 0.70 RXRA (0.61) PTPN5RXRARXRBRXRGPTGS2

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-20230357214-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY PHENEX PHARMACEUTICALS AKTIENGESELLSCHAFT (DE) 2023-11-09 — — 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-20230357214-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY NR1H2, NR1H3, NR1H4 PTPN5 2284/4885RXRA 26/4885RXRB 12/4885

“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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