SCHEMBL7918809

SCHEMBL7918809

O=C1CC=CC=C1C=Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
RAB9A P51151 3/20 0.37
RECQL P46063 2/20 0.37
PKM P14618 1/20 0.37
CHAT P28329 2/20 0.37
TRPA1 O75762 3/20 0.37
RELA Q04206 2/20 0.37
NFE2L2 Q16236 2/20 0.37
GLA P06280 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 2/20 0.36
MAOB P27338 3/20 0.35
LMNA P02545 2/20 0.35
CYP19A1 P11511 1/20 0.35
MAOA P21397 1/20 0.35
ALOX5 P09917 1/20 0.35
MAPK1 P28482 1/20 0.35
MAPT P10636 2/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL7915791 0.84
SCHEMBL9224606 0.84 ALDH1A1 (0.34) SMN1; SMN2ALDH1A1LMNAMAPTHPGD
SCHEMBL5359585 0.73 TRPA1 (0.40) SMN1; SMN2CHATTRPA1RELANFE2L2
SCHEMBL8972692 0.73 CHAT (0.42) CHATTRPA1RELANFE2L2ALDH1A1
SCHEMBL8972699 0.73 CHAT (0.42) CHATTRPA1RELANFE2L2ALDH1A1
SCHEMBL1918197 0.73 HCAR2 (0.35) SMN1; SMN2PKMGLATDP1ALDH1A1
SCHEMBL9789777 0.70 NFE2L2 (0.33) SMN1; SMN2RECQLNFE2L2ALDH1A1LMNA
SCHEMBL931533 0.70
SCHEMBL272985 0.69 CMA1 (0.42) SMN1; SMN2RECQLCHATTRPA1NFE2L2
SCHEMBL3868432 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed