SCHEMBL4631658

SCHEMBL4631658

C=CNCC=CCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.62
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
ARG2 P78540 1/20 0.44
TOP1 P11387 1/20 0.41
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH7 P40394 1/20 0.38
MAPK1 P28482 1/20 0.38
GAA P10253 1/20 0.36
KCNH2 Q12809 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.33
CALM1 P0DP23 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
SCHEMBL155055 0.79 MAOB (1.00) MAOBCA1CA2ARG2TOP1
SCHEMBL1524697 0.79 MAOB (1.00) MAOBCA1CA2ARG2TOP1
SCHEMBL155054 0.79 MAOB (1.00) MAOBCA1CA2ARG2TOP1
Hydrochloric Acid SCHEMBL11773964 0.79 GPR52 (0.42) GAAKCNH2
SCHEMBL6668268 0.76 MAOB (0.52) MAOBCA1CA2ARG2TOP1
SCHEMBL8074747 0.76 MAOB (0.71) MAOBCA1CA2ARG2TOP1
SCHEMBL8074750 0.76 MAOB (0.71) MAOBCA1CA2ARG2TOP1
SCHEMBL4430706 0.74 MAOB (0.68) MAOBCA1CA2ARG2TOP1
SCHEMBL20824994 0.74
SCHEMBL248336 0.73 ADH1B (0.60) CA2ADH1BADH1CADH1AADH7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4479879-A CATIONIC POLYMER FLOCCULANTS, ANIONIC POLYMER FLOCCULANTS KURITA WATER INDUSTRIES LTD. (JP) 1984-10-30 US claimed
JP-55049150-A None JP disclosed
EP-1927889-A1 Lithographic printing plate precursor FUJIFILM Corporation (JP) 2008-06-04 EP disclosed
US-6558873-B1 Interlayer containing a compound capable of forming a complex with aluminum and a photopolymerizable photosensitive layer containing a photopolymerization initiator, an addition polymerizable compound capable of complexing with aluminum FUJI PHOTO FILM CO., LTD. (JP) 2003-05-06 US disclosed
EP-1091251-A2 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2001-04-11 EP disclosed
US-5009880-A Mixture of an anionic and cationic polymer for shampoos, skin lotions, nail strengtheners and hair dyeing; improved fixing and anchoring; smoothness; gloss L'OREAL (FR) 1991-04-23 US disclosed
US-4479879-A CATIONIC POLYMER FLOCCULANTS, ANIONIC POLYMER FLOCCULANTS KURITA WATER INDUSTRIES LTD. (JP) 1984-10-30 US disclosed
US-4445521-A ANIONIC AND CATIONIC POLYMER COMBINATION L'OREAL (FR) 1984-05-01 US disclosed
US-4240450-A HAIR CONDITIONER OF ANIONIC POLYMERS AND CATIONIC POLYMERS L'OREAL (FR) 1980-12-23 US disclosed
JP-S5549150-A PRODUCTION OF HEAT REGENERATING ION EXCHANGE RESIN MITSUBISHI CHEM IND LTD 1980-04-09 JP disclosed