SCHEMBL26388982

SCHEMBL26388982

CC(C)(O)Cn1cc(I)c(C(F)(F)F)n1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.36
FFAR1 O14842 2/20 0.34
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL26389004 0.86
SCHEMBL1359371 0.80 LRRK2 (0.36) LRRK2FFAR1LMNAPOLB
SCHEMBL17076655 0.80 LRRK2 (0.36) LRRK2FFAR1LMNAPOLB
SCHEMBL24013536 0.79 LRRK2 (0.33) LRRK2
SCHEMBL1358932 0.77 LRRK2 (0.38) LRRK2FFAR1
SCHEMBL26388988 0.77 FFAR1 (0.34) LRRK2FFAR1
SCHEMBL21408586 0.76 LMNA (0.39) LRRK2LMNAPOLB
SCHEMBL26388984 0.76 FFAR1 (0.36) LRRK2FFAR1
SCHEMBL21819821 0.75 ACHE (0.31)
SCHEMBL20606770 0.75 ACHE (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023192901-A9 QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS ESCIENT PHARMACEUTICALS, INC. (US) 2023-12-14 WO disclosed
WO-2023192901-A1 QUINOLINE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS ESCIENT PHARMACEUTICALS, INC. (US) 2023-10-05 WO disclosed