SCHEMBL11491069

SCHEMBL11491069

C=CCN1C(C)(C)CC(NC(=O)c2ccccc2)CC1(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 5/20 0.51
KDM4E B2RXH2 2/20 0.48
GAA P10253 2/20 0.48
MCHR1 Q99705 1/20 0.44
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
MAOB P27338 1/20 0.43
KMT2A Q03164 3/20 0.43
NPSR1 Q6W5P4 1/20 0.43
OPRD1 P41143 2/20 0.42
OPRM1 P35372 1/20 0.42
HPGD P15428 1/20 0.42
MEN1 O00255 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CCR3 P51677 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40

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
SCHEMBL11484910 0.84 EZH2 (0.56) EZH2KDM4EGAACARM1PRMT6
SCHEMBL11477683 0.82 EZH2 (0.53) EZH2KDM4EGAAMCHR1MAOB
SCHEMBL19414177 0.81 GAA (0.40) KDM4EGAAKMT2AOPRD1NPC1
SCHEMBL10526044 0.81 EZH2 (0.52) EZH2KDM4EGAACARM1PRMT6
SCHEMBL10525914 0.80 EZH2 (0.51) EZH2KDM4EGAAMCHR1CARM1
SCHEMBL3916703 0.79 EZH2 (0.59) EZH2KDM4EGAACARM1PRMT6
SCHEMBL3916706 0.79 KDM4E (0.72) EZH2KDM4EGAACARM1PRMT6
SCHEMBL4977116 0.79 EZH2 (0.59) EZH2KDM4EGAACARM1PRMT6
Benzoic Acid SCHEMBL9813623 0.79 OPRD1 (0.41) KMT2AOPRD1OPRM1HPGDMEN1
SCHEMBL10560828 0.76 LMNA (0.40) KDM4EGAAKMT2ANPSR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4223147-A POLYMER STABILIZERS BAYER AKTIENGESELLSCHAFT (DE) 1980-09-16 US disclosed
US-4178279-A FIBERS AND FOILS BAYER AKTIENGESELLSCHAFT (DE) 1979-12-11 US disclosed
US-4153596-A PHOTOSTABILITY BAYER AKTIENGESELLSCHAFT (DE) 1979-05-08 US disclosed