SCHEMBL31389987

SCHEMBL31389987

OC1CC(n2nccc2C(F)(F)F)C1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.43
AR P10275 1/20 0.34
SPR P35270 1/20 0.33
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
PKM P14618 1/20 0.30
ALOX15 P16050 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL23036782 0.83 MEN1 (0.33) LRRK2SPRMEN1ALDH1A1MAPT
SCHEMBL21503409 0.83 MEN1 (0.33) LRRK2SPRMEN1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL21492715 0.81 MEN1 (0.33) LRRK2SPRMEN1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL21492713 0.81 MEN1 (0.33) LRRK2SPRMEN1ALDH1A1MAPT
SCHEMBL21492001 0.77 SPR (0.35) LRRK2SPRMEN1KMT2A
SCHEMBL30146858 0.77 PIK3CD (0.38) SPRMEN1ALDH1A1MAPTPKM
SCHEMBL30146873 0.77 PIK3CD (0.38) SPRMEN1ALDH1A1MAPTPKM
SCHEMBL31389663 0.74 SPR (0.32) SPR
SCHEMBL31389402 0.74 KDM4E (0.35) LRRK2MEN1ALDH1A1MAPTPKM
SCHEMBL21037755 0.73 GAA (0.59) SPRMEN1ALDH1A1MAPTPKM

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-2025043225-A2 DEGRADERS OF CYCLIN-DEPENDENT KINASE 2 GENENTECH, INC. (US) 2025-02-27 WO disclosed