SCHEMBL30969262

SCHEMBL30969262

NC(=O)c1ccc(OCCN2CCC(N3CCCC3)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.65
PSMB1 P20618 2/20 0.58
PSMB5 P28074 2/20 0.58
PSMB2 P49721 2/20 0.58
LTA4H P09960 2/20 0.54
MAOB P27338 1/20 0.51
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
KDM4E B2RXH2 1/20 0.50
CHEK2 O96017 1/20 0.49

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
SCHEMBL3026592 0.87 PSMB1 (0.75) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL30969263 0.85 PSMB1 (0.78) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL30969245 0.84 HRH3 (0.56) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL5779141 0.83 SIGMAR1 (0.63) HRH3KDM4E
SCHEMBL14287744 0.83 L3MBTL3 (0.67) HRH3PSMB1PSMB5PSMB2KDM4E
Hydrochloric Acid SCHEMBL3859178 0.82 SIGMAR1 (0.65) HRH3KDM4E
SCHEMBL30969243 0.82 PSMB1 (0.72) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL30969292 0.80 HRH3 (0.54) HRH3PSMB1PSMB5PSMB2LTA4H
SCHEMBL182828 0.80 HRH3 (0.72) HRH3LTA4H
SCHEMBL2002718 0.79 HRH3 (0.72) HRH3PSMB1PSMB5PSMB2MAOB

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-4642766-A1 COMPOUNDS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-11-05 EP disclosed
WO-2024145585-A1 COMPOUNDS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-07-04 WO disclosed