SCHEMBL8038720

SCHEMBL8038720

Cc1ccc(C(CC2CCCCC2)C2CCCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
METAP2 P50579 1/20 0.40
METAP1 P53582 1/20 0.40
PKM P14618 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MITF O75030 1/20 0.38
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
TSHR P16473 2/20 0.38
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
CHRNA7 P36544 1/20 0.36
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL8467745 0.83 SLC6A3 (0.64) SLC6A2SLC6A4SLC6A3NPC1RAB9A
SCHEMBL3966889 0.82 MEN1 (0.53) SLC6A2SLC6A4SLC6A3PKMCTDSP1
SCHEMBL10453959 0.82 MEN1 (0.53) SLC6A2SLC6A4SLC6A3PKMCTDSP1
SCHEMBL8040904 0.79 SLC6A3 (0.46) SLC6A2SLC6A4SLC6A3PKMCTDSP1
SCHEMBL9153116 0.79 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3PKMCTDSP1
SCHEMBL27969237 0.79 METAP2 (0.42) SLC6A2SLC6A4SLC6A3METAP2METAP1
SCHEMBL28979502 0.77 NPC1 (0.44) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL22868100 0.77 METAP2 (0.47) SLC6A2SLC6A4SLC6A3METAP2METAP1
SCHEMBL10021113 0.77 METAP2 (0.47) METAP2METAP1MEN1KMT2AHSD17B1
SCHEMBL28033476 0.76 METAP2 (0.40) SLC6A2SLC6A4SLC6A3METAP2METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113433727-A Electrochromic optical film and preparation method thereof 珠海光驭科技有限公司 2021-09-24 CN disclosed
EP-0727473-B1 Liquid crystaline alkynyltolan compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 2000-01-12 EP disclosed
US-5833879-A LOW TEMPERATURE MISCIBILITY AND COMPATIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS; DISPLAYS CONTAINING MIXTURES OF AT LEAST TWO COMPOUNDS, PHYSICAL PROPERTIES CHISSO CORPORATION (JP) 1998-11-10 US disclosed
EP-0727473-A2 Liquid crystaline alkynyltolan compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1996-08-21 EP disclosed