SCHEMBL29627409

SCHEMBL29627409

CCCCCCC(C)(C)c1cc(OC)c(C(=O)Nc2ccccc2N2CCOCC2)c(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
TSHR P16473 1/20 0.52
MAPK1 P28482 1/20 0.52
GAA P10253 2/20 0.51
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 6/20 0.51
LMNA P02545 2/20 0.51
RAB9A P51151 1/20 0.51
MAPT P10636 3/20 0.49
ABCB1 P08183 1/20 0.49
ABCG2 Q9UNQ0 1/20 0.49
HTT P42858 2/20 0.48
PKM P14618 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CNR2 P34972 1/20 0.48
ATM Q13315 1/20 0.47

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
SCHEMBL24539602 0.88 SMN1; SMN2 (0.57) SMN1; SMN2TSHRKMT2AALDH1A1LMNA
SCHEMBL29627391 0.85 MAPT (0.53) SMN1; SMN2GAAKMT2AALDH1A1LMNA
SCHEMBL29627407 0.83 MAPT (0.50) TSHRMAPK1GAAKMT2AALDH1A1
SCHEMBL24539594 0.78 MAPK1 (0.47) SMN1; SMN2TSHRMAPK1GAAKMT2A
SCHEMBL29627400 0.76 ALDH1A1 (0.52) MAPK1ALDH1A1LMNAMAPTPKM
SCHEMBL29627403 0.76 NPC1 (0.53) SMN1; SMN2TSHRMAPK1GAAKMT2A
SCHEMBL29627405 0.74 NPC1 (0.49) SMN1; SMN2GAAKMT2AALDH1A1RAB9A
SCHEMBL29627393 0.74 HTR1D (0.44) TSHRMAPK1GAAKMT2ARAB9A
SCHEMBL24539595 0.72 MAPT (0.52) SMN1; SMN2MAPK1KMT2AALDH1A1LMNA
SCHEMBL24539600 0.71 SETD2 (0.45) SMN1; SMN2KMT2AALDH1A1LMNARAB9A

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-2022133058-A1 RESORCINOL-BASED COMPOUNDS AND USES THEREOF SUTTER BAY HOSPITALS (US) 2022-06-23 WO disclosed