SCHEMBL9575645

SCHEMBL9575645

CCCCCCCCCCCCCCC1=NCCN1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HTR1D P28221 4/20 0.56
▸ NISCH Q9Y2I1 3/20 0.46
▸ MAOA P21397 1/20 0.46
▸ MAOB P27338 1/20 0.46
▸ ADRA2B P18089 2/20 0.42
▸ ADRA2C P18825 2/20 0.42
▸ HTR1A P08908 1/20 0.42
▸ ADRA2A P08913 1/20 0.42
▸ TAAR1 Q96RJ0 3/20 0.42
▸ HTR1B P28222 1/20 0.40

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
SCHEMBL1736375 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B
SCHEMBL5680179 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B
SCHEMBL7756299 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B
SCHEMBL10621181 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B
SCHEMBL107099 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B
Hydrochloric Acid SCHEMBL9630422 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B
SCHEMBL10491831 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B
SCHEMBL3451047 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B
SCHEMBL750716 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B
SCHEMBL5675527 1.00 HTR1D (0.56) HTR1DNISCHMAOAMAOBADRA2B

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
EP-0331507-B1 POLYVINYL CHLORIDE PLASTISOL COMPOSITION ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1993-05-19 — — EP disclosed
US-4977201-A Blended with modified epoxy resin, blocked isocyanate, latent curing for resin as tackifier, automobile undercoatings ASAHI DENKA KOGYO K.K. (JP) 1990-12-11 — — US disclosed
EP-0331507-A1 Polyvinyl chloride plastisol composition ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1989-09-06 — — EP disclosed
US-4070294-A Lubricant compositions containing imidazoline-phosphonate salts as antiwear agents MOBIL OIL CORPORATION (US) 1978-01-24 — — US disclosed
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