SCHEMBL14287678

SCHEMBL14287678

c1cc(OCCCN2CCCCC2)ccc1CNCCN1CCCCC1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 17/20 0.68
▸ ACHE P22303 1/20 0.67
▸ RAD52 P43351 1/20 0.67
▸ KMT2A Q03164 1/20 0.63
▸ CACNA1B Q00975 2/20 0.60
▸ CACNA1H O95180 1/20 0.59

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
SCHEMBL14287660 1.00 HRH3 (0.68) HRH3ACHERAD52KMT2ACACNA1B
SCHEMBL5107405 0.96 HRH3 (0.64) HRH3ACHERAD52KMT2A
SCHEMBL14287674 0.94 HRH3 (0.68) HRH3ACHERAD52CACNA1BCACNA1H
SCHEMBL5097548 0.92 HRH3 (0.71) HRH3ACHERAD52KMT2A
Hydrochloric Acid SCHEMBL5100664 0.91 HRH3 (0.70) HRH3ACHERAD52KMT2A
SCHEMBL14287677 0.89 HRH3 (0.66) HRH3ACHERAD52
SCHEMBL14287710 0.88 HRH3 (0.70) HRH3ACHERAD52
SCHEMBL5100294 0.88 KMT2A (0.59) HRH3ACHERAD52KMT2A
SCHEMBL14287672 0.87 HRH3 (0.71) HRH3ACHERAD52
SCHEMBL14287670 0.86 HRH3 (0.70) HRH3ACHERAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7314937-B2 Non-imidazole aryl alkylamines compounds as histamine H3 receptor antagonists, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2008-01-01 — — US disclosed
US-7314937-B2 Non-imidazole aryl alkylamines compounds as histamine H3 receptor antagonists, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2008-01-01 — — US disclosed
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