SCHEMBL9480625

SCHEMBL9480625

CCN(CC)C(=O)CCCCCN1CCC(NCc2ccc(Nc3ccnc4cc(Cl)ccc34)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ HRH3 Q9Y5N1 7/20 0.48
▸ APP P05067 2/20 0.45
▸ RAD52 P43351 1/20 0.44
▸ GFER P55789 1/20 0.44
▸ NSD2 O96028 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
Trifluoroacetic Acid SCHEMBL9482134 0.95 ANPEP (0.45) ANPEPMEN1KMT2AKDM4EALDH1A1
SCHEMBL9480735 0.88 HRH3 (0.46) ANPEPMEN1KMT2AKDM4EALDH1A1
SCHEMBL9481024 0.87 HRH3 (0.46) ANPEPMEN1KMT2AKDM4EALDH1A1
SCHEMBL9480667 0.86 HRH3 (0.57) MEN1KMT2AKDM4EALDH1A1HRH3
SCHEMBL9481237 0.84 KDM4E (0.49) MEN1KMT2AKDM4EALDH1A1HRH3
SCHEMBL9482297 0.79 HRH3 (0.51) ANPEPMEN1KMT2AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL9481001 0.78 HRH3 (0.50) ANPEPMEN1KMT2AKDM4EALDH1A1
SCHEMBL9481249 0.78 BACE1 (0.60) MEN1KMT2AKDM4EALDH1A1HRH3
SCHEMBL9483689 0.77 HRH3 (0.54) MEN1KMT2AKDM4EALDH1A1HRH3
SCHEMBL9481058 0.76 HRH3 (0.51) MEN1KMT2AKDM4EALDH1A1HRH3

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-5216165-A N-substituted aminoquinolines as analgesic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1993-06-01 — — US claimed
US-5216165-A N-substituted aminoquinolines as analgesic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1993-06-01 — — US disclosed
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