SCHEMBL30510470

SCHEMBL30510470

CC1(C)OB(c2cc(F)cnc2C(F)(F)F)OC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 1/20 0.36
▸ LIPG Q9Y5X9 1/20 0.36
▸ LIPE Q05469 7/20 0.33
▸ CXCR2 P25025 2/20 0.32
▸ NR1H2 P55055 1/20 0.30
▸ NR1H3 Q13133 1/20 0.30
▸ FFAR1 O14842 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
SCHEMBL25426698 1.00 LPL (0.36) LPLLIPGLIPECXCR2NR1H2
SCHEMBL30510529 0.84 LIPE (0.35) LIPENR1H2NR1H3FFAR1
SCHEMBL25426051 0.84 LIPE (0.35) LIPENR1H2NR1H3FFAR1
SCHEMBL15393439 0.82 LPL (0.41) LPLLIPGLIPECXCR2FFAR1
SCHEMBL31378591 0.79 LPL (0.39) LPLLIPGCXCR2
SCHEMBL17752336 0.79 LPL (0.39) LPLLIPGCXCR2
SCHEMBL15392968 0.78 LPL (0.38) LPLLIPGLIPECXCR2
SCHEMBL21911080 0.78 LPL (0.38) LPLLIPGLIPECXCR2FFAR1
SCHEMBL30508645 0.78 LPL (0.38) LPLLIPGLIPECXCR2
SCHEMBL18865569 0.75 LPL (0.36) LPLLIPGLIPECXCR2

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
WO-2023122093-A1 REV-ERB AGONISTS FOR TH17-MEDIATED INFLAMMATORY DISORDERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2023-06-29 — — WO disclosed
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