SCHEMBL5367649

SCHEMBL5367649

CC(C)(C)[Si](C)(C)Oc1ccc(C2CCC(NS(=O)(=O)c3ccc(C#N)cc3)CC2)c(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.40
POLB P06746 1/20 0.39
P4HB P07237 1/20 0.39
HRH2 P25021 2/20 0.39
HRH1 P35367 2/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
HSD11B1 P28845 3/20 0.38
GLA P06280 1/20 0.37
MAPT P10636 1/20 0.36
TP53 P04637 1/20 0.35
DRD2 P14416 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35

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
SCHEMBL5367638 1.00 THRB (0.40) THRBPOLBP4HBHRH2HRH1
SCHEMBL5360412 0.91 HRH2 (0.41) P4HBHRH2HRH1ALDH1A1LMNA
SCHEMBL5360407 0.91 HRH2 (0.41) P4HBHRH2HRH1ALDH1A1LMNA
SCHEMBL5360942 0.88 POLB (0.40) POLBALDH1A1LMNAGAAGLA
SCHEMBL5359455 0.88 ALDH1A1 (0.45) POLBALDH1A1LMNAGAAGLA
SCHEMBL5363070 0.88 ALDH1A1 (0.45) POLBALDH1A1LMNAGAAGLA
SCHEMBL5446985 0.88 POLB (0.42) POLBGAAGLATP53DRD2
SCHEMBL5359450 0.88 ALDH1A1 (0.45) POLBALDH1A1LMNAGAAGLA
SCHEMBL5446988 0.88 POLB (0.42) POLBGAAGLATP53DRD2
SCHEMBL5360944 0.88 POLB (0.40) POLBALDH1A1LMNAGAAGLA

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
US-7282592-B2 Resorcinol derivatives WARNER-LAMBERT COMPANY (US) 2007-10-16 US disclosed
US-7173052-B2 Resorcinol derivatives PFIZER INC. (US) 2007-02-06 US disclosed