SCHEMBL11527474

SCHEMBL11527474

CC1(C)CC(O[Si](C)(OC2CC(C)(C)N(Cc3ccccc3)C(C)(C)C2)OC2CC(C)(C)N(Cc3ccccc3)C(C)(C)C2)CC(C)(C)N1Cc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.38
CTSG P08311 1/20 0.38
PRTN3 P24158 1/20 0.38
MC4R P32245 1/20 0.37
GAA P10253 2/20 0.36
ACHE P22303 1/20 0.35
HTT P42858 1/20 0.35
LMNA P02545 1/20 0.34
SIGMAR1 Q99720 2/20 0.34
TSHR P16473 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
AMPD2 Q01433 1/20 0.34
OPRK1 P41145 1/20 0.33

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
SCHEMBL11527520 0.85 OPRK1 (0.38) ELANEMC4RGAAACHEHTT
SCHEMBL11177639 0.80 CTSL (0.45) MC4RGAASIGMAR1
SCHEMBL14354626 0.78 GAA (0.39) ELANECTSGPRTN3MC4RGAA
SCHEMBL11233987 0.78 MC4R (0.36) ELANEMC4RGAAACHESIGMAR1
SCHEMBL7771026 0.77 TDP1 (0.40) MC4RGAASIGMAR1MEN1KMT2A
SCHEMBL10895930 0.77 CYP2C19 (0.39) ELANEMC4RGAAHTTTSHR
SCHEMBL39509 0.76 KMT2A (0.44) ELANEGAAACHESIGMAR1TSHR
SCHEMBL1309638 0.76 GAA (0.41) ELANEMC4RGAAACHELMNA
SCHEMBL11088315 0.76 MEN1 (0.41) ELANEMC4RGAAACHELMNA
SCHEMBL11173679 0.75 DRD2 (0.34) ELANEMC4RGAAACHESIGMAR1

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
US-4177186-A 4-SILOXY-DERIVATIVES OF STERICALLY HINDERED PIPERIDINES CIBA-GEIGY CORPORATION (US) 1979-12-04 US disclosed