SCHEMBL31648336

SCHEMBL31648336

Cc1c(OC(F)F)cccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 3/20 0.38
▸ BTK Q06187 3/20 0.38
▸ LPL P06858 3/20 0.35
▸ LIPG Q9Y5X9 3/20 0.35
▸ TNF P01375 1/20 0.33
▸ NR1I2 O75469 1/20 0.32
▸ P2RX7 Q99572 2/20 0.31
▸ LIPE Q05469 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
SCHEMBL263386 0.86 LPL (0.39) LPLLIPGTNFNR1I2LIPE
SCHEMBL29574549 0.86 LPL (0.39) LPLLIPGTNFNR1I2LIPE
SCHEMBL2026497 0.85 LPL (0.38) JAK2BTKLPLLIPGTNF
SCHEMBL26197525 0.82 LPL (0.33) JAK2BTKLPLLIPGTNF
SCHEMBL1870652 0.81 JAK2 (0.38) JAK2BTKLPLLIPG
SCHEMBL26187067 0.79 LIPE (0.38) JAK2BTKLPLLIPGLIPE
SCHEMBL4315605 0.78 KMT2A (0.35) LPLLIPGTNFLIPE
SCHEMBL11927624 0.78 LPL (0.44) JAK2BTKLPLLIPGP2RX7
SCHEMBL20836424 0.78 JAK2 (0.35) JAK2BTKLPLLIPG
SCHEMBL30594525 0.78 JAK2 (0.35) JAK2BTKLPLLIPG

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-2025132946-A1 PHENYLPYRROLIDINE DERIVATIVES AND THEIR USE AS POI-THETA DERIVATIVES BREAKPOINT THERAPEUTICS GMBH (DE) 2025-06-26 — — WO disclosed
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