SCHEMBL11352087

SCHEMBL11352087

CCCC(Oc1cccc(C)c1C)C1=NCCN1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NISCH Q9Y2I1 4/20 0.52
▸ ADRA2A P08913 14/20 0.50
▸ ADRA2B P18089 14/20 0.50
▸ ADRA2C P18825 14/20 0.50
▸ HTR1A P08908 2/20 0.47
▸ MAOA P21397 1/20 0.44
▸ MAOB P27338 1/20 0.44

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
Hydrochloric Acid SCHEMBL11346455 0.99 NISCH (0.51) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL545961 0.90 NISCH (0.52) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL11224297 0.90 NISCH (0.54) NISCHADRA2AADRA2BADRA2CHTR1A
Hydrochloric Acid SCHEMBL9654753 0.89 NISCH (0.53) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL11377087 0.88 ADRA2A (0.52) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL3961636 0.88 NISCH (0.50) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL545845 0.83 NISCH (0.50) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL545847 0.83 NISCH (0.50) NISCHADRA2AADRA2BADRA2CHTR1A
SCHEMBL11369733 0.81 ADRA2A (0.53) NISCHADRA2AADRA2BADRA2CHTR1A
Hydrochloric Acid SCHEMBL9654915 0.79 NISCH (0.77) NISCHADRA2AADRA2BADRA2CHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4276302-A PARASITICIDES CIBA-GEIGY CORPORATION (US) 1981-06-30 — — US claimed
EP-0011596-B1 2-(ALPHA-PHENOXY-ALKYL)-IMIDAZOLINES AND THEIR SALTS, THEIR PREPARATION AND USE, AND AGENTS AGAINST PHYTOPARASITIC AND ZOOPARASITIC MITES CONTAINING THEM CIBA-GEIGY AG (CH) 1981-12-30 — — EP disclosed
US-4276302-A PARASITICIDES CIBA-GEIGY CORPORATION (US) 1981-06-30 — — US disclosed
EP-0011596-A1 2-(Alpha-phenoxy-alkyl)-imidazolines and their salts, their preparation and use, and agents against phytoparasitic and zooparasitic mites containing them CIBA-GEIGY AG (CH) 1980-05-28 — — EP disclosed
EP-0011596-A1 2-(Alpha-phenoxy-alkyl)-imidazolines and their salts, their preparation and use, and agents against phytoparasitic and zooparasitic mites containing them CIBA-GEIGY AG (CH) 1980-05-28 — — EP disclosed
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