SCHEMBL9823364

SCHEMBL9823364

C=C(c1ccc(N(C)C)cc1)c1ccc(C)c(C)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
ALDH1A1 P00352 7/20 0.50
MAPT P10636 4/20 0.50
HPGD P15428 3/20 0.44
TSHR P16473 4/20 0.42
ALOX15 P16050 2/20 0.42
CYP3A4 P08684 2/20 0.42
MAPK1 P28482 2/20 0.42
HBB P68871 1/20 0.42
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SLC2A1 P11166 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 3/20 0.39

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
SCHEMBL8410463 0.84 PRSS1 (0.54) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL441802 0.84 MEN1 (0.83) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL12679042 0.84 MEN1 (0.83) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL17811466 0.81 MEN1 (0.78) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL9099853 0.80 MEN1 (0.70) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL8642659 0.79 CES2 (0.60) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL29882815 0.79 CES2 (0.60) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL10473322 0.78 MEN1 (0.56) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL10473921 0.78 KMT2A (0.72) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL607222 0.76 KMT2A (1.00) MEN1KMT2AALDH1A1MAPTHPGD

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
EP-0242170-B1 DIVINYL COMPOUNDS AND CHROMOGENIC RECORDING-MATERIAL PREPARED BY USE THEREOF YAMADA CHEMICAL CO., LTD. (JP) 1991-09-18 EP disclosed
US-4835291-A Divinyl compounds and chromogenic recording-material prepared by using thereof YAMADA CHEMICAL CO., LTD. (JP) 1989-05-30 US disclosed
EP-0242170-A2 Divinyl compounds and chromogenic recording-material prepared by use thereof YAMADA CHEMICAL CO., LTD. (JP) 1987-10-21 EP disclosed