SCHEMBL11149157

SCHEMBL11149157

CC1(C)CC(CCNC(=O)C(=O)NCCC2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
GAA P10253 3/20 0.47
POLB P06746 1/20 0.37
EZH2 Q15910 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
ATM Q13315 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HTT P42858 1/20 0.34
GLA P06280 1/20 0.34
CHRM1 P11229 1/20 0.34
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
MEN1 O00255 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
SCHEMBL11868689 0.89 TSHR (0.56) TSHRGAAPOLBEZH2L3MBTL1
SCHEMBL11868852 0.87 TSHR (0.55) TSHRGAAPOLBEZH2L3MBTL1
SCHEMBL11857705 0.87 TSHR (0.55) TSHRGAAPOLBEZH2L3MBTL1
SCHEMBL11865149 0.87 TSHR (0.55) TSHRGAAPOLBEZH2HSD17B10
SCHEMBL11862108 0.84 TSHR (0.52) TSHRGAAPOLBEZH2L3MBTL1
SCHEMBL11857627 0.84 TSHR (0.52) TSHRGAAPOLBEZH2L3MBTL1
SCHEMBL11869790 0.84 TSHR (0.52) TSHRGAAPOLBEZH2L3MBTL1
SCHEMBL11868610 0.83 TSHR (0.51) TSHRGAAPOLBHSD17B10KMT2A
SCHEMBL11862498 0.82 TSHR (0.50) TSHRGAA
SCHEMBL11861228 0.82 TSHR (0.50) TSHRGAAPOLBKMT2ARECQL

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4396735-A N-HETEROCYCLIC COMPOUND AND A HETEROCYCLIC ACID HYDRAZIDE ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1983-08-02 US disclosed
US-4362831-A A HINDERED AND HETEROCYCLIC AMINE WITH A THIOALKANOIC ACID AMIDE ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1982-12-07 US disclosed
US-4123418-A BIS-(U8I8I8L8L-PENTAMETHY TETRAMETHYL-4-PIPERIDYL)-SUBERATE CIBA-GEIGY CORPORATION (US) 1978-10-31 US disclosed
US-4110304-A STERICALLY HINDERED CYCLIC AMINE CIBA-GEIGY CORPORATION (US) 1978-08-29 US disclosed
US-3937711-A POLYMERIC STABILIZERS, POLYOLEFINS CIBA-GEIGY CORPORATION (US) 1976-02-10 US disclosed