SCHEMBL24901455

SCHEMBL24901455

Cc1cc(OC(F)(F)CO[Si](C(C)C)(C(C)C)C(C)C)ccc1Br

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HAO1 Q9UJM8 1/20 0.35
LMNA P02545 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
STAT3 P40763 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.32
HRH4 Q9H3N8 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
POLB P06746 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
SCHEMBL30756731 0.81 TRPV1 (0.33) SMN1; SMN2MAPT
SCHEMBL2038046 0.76 SMN1; SMN2 (0.39) HAO1LMNAALOX15TSHRMAPK1
SCHEMBL24901459 0.75 SMN1; SMN2 (0.41) HAO1LMNAALOX15TSHRMAPK1
SCHEMBL17205115 0.73 HAO1 (0.44) HAO1LMNAALOX15TSHRMAPK1
SCHEMBL29427162 0.72 GPR3 (0.45) HAO1LMNAALOX15SMN1; SMN2MAPT
SCHEMBL1221631 0.72 GPR3 (0.45) HAO1LMNAALOX15SMN1; SMN2MAPT
SCHEMBL24901535 0.72 MAPT (0.32) MAPT
SCHEMBL24901703 0.69 MGAM (0.39) LMNASMN1; SMN2HRH4
SCHEMBL506056 0.69 PARP1 (0.33) HAO1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL24901457 0.69 HTR2A (0.30)

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-2023286768-A1 HYDROGENATED QUINOXALINES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-01-19 WO disclosed