SCHEMBL6634760

SCHEMBL6634760

c1cc(OCCCCC2CCNCC2)ccc1CNCCN1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 6/20 0.51
▸ ITGA2B P08514 6/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ HRH3 Q9Y5N1 9/20 0.50
▸ ACHE P22303 2/20 0.47
▸ DPP7 Q9UHL4 1/20 0.46
▸ LTA4H P09960 1/20 0.46
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2D6 P10635 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
SCHEMBL5107405 0.81 HRH3 (0.64) KMT2AHRH3ACHE
SCHEMBL14287678 0.80 HRH3 (0.68) KMT2AHRH3ACHE
SCHEMBL14287660 0.80 HRH3 (0.68) KMT2AHRH3ACHE
SCHEMBL5100294 0.79 KMT2A (0.59) KMT2AHRH3ACHEDPP7LTA4H
SCHEMBL6630944 0.78 HRH3 (0.44) KMT2AHRH3LTA4HCYP3A4CYP2D6
Hydrochloric Acid SCHEMBL6635326 0.77 HRH3 (0.43) KMT2AHRH3LTA4HCYP3A4CYP2D6
SCHEMBL4088664 0.77 HRH3 (0.70) ITGB3ITGA2BHRH3ACHE
SCHEMBL14287674 0.75 HRH3 (0.68) HRH3ACHE
SCHEMBL23710932 0.74 KMT2A (0.48) KMT2AHRH3ACHELTA4HCYP2D6
SCHEMBL5097548 0.74 HRH3 (0.71) KMT2AHRH3ACHE

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
EP-1379493-A2 NON-IMIDAZOLE ARYL ALKYLAMINES COMPOUNDS AS HISTAMINE H3 RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES Eli Lilly and Company (US) 2004-01-14 — — EP disclosed
WO-2002076925-A2 NON-IMIDAZOLE ARYL ALKYLAMINES COMPOUNDS AS HISTAMINE H3 RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2002-10-03 — — WO disclosed
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