SCHEMBL11200694

SCHEMBL11200694

C=CCNCCc1ccccc1C=C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 1/20 0.39
▸ ADRB1 P08588 1/20 0.39
▸ MPO P05164 4/20 0.37
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KDM4E B2RXH2 3/20 0.33
▸ GAA P10253 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ USP2 O75604 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32

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
SCHEMBL1110921 0.81 SLC6A2 (0.43) ADRB2ADRB1ALDH1A1MAPTKDM4E
SCHEMBL11177632 0.81 DRD2 (0.40) MPOALDH1A1SLC6A2
SCHEMBL11173432 0.79 MPO (0.58) MPOMAPTKDM4EGAAKMT2A
SCHEMBL13574203 0.79 TAAR1 (0.55) ADRB2ADRB1ALDH1A1SLC6A2SLC6A4
SCHEMBL2572378 0.79 TAAR1 (0.55) MPOKMT2ASLC6A4
SCHEMBL595200 0.78 ALDH1A1 (0.48) ALDH1A1MAPTKMT2A
SCHEMBL29377653 0.78 ALDH1A1 (0.48) ALDH1A1MAPTKMT2A
SCHEMBL23252534 0.78 TAAR1 (0.53) ALDH1A1HTTKDM4EKMT2ASLC6A2
SCHEMBL5072509 0.76 ALDH1A1 (0.46) ALDH1A1MAPTKMT2A
SCHEMBL10316496 0.76 HPGD (0.53) ALDH1A1MAPTHTTKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4376687-A ELECTRODEPOSITION OF CATIONIC POLYMERS BASED ON AN AMINE-CONTAINING UNSATURATED CARBO COMPOUND, AN ACRYLIC ACID OR ESTER, AN AMINE-CONTAINING HYDROXY COMPOUND, A BLOCKED ISOLYANATE, AND ACID; AUTO COATINGS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1983-03-15 — — US disclosed
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