SCHEMBL30951945

SCHEMBL30951945

CC1(C)OB(c2cccc3cc(N4CCOCC4)ccc23)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGMN Q99538 1/20 0.40
MAPT P10636 4/20 0.39
LMNA P02545 3/20 0.39
HTT P42858 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NSD2 O96028 1/20 0.39
TSHR P16473 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
CASP6 P55212 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B1 P14061 1/20 0.39
HSD17B2 P37059 1/20 0.39
AKR1C3 P42330 1/20 0.39
APAF1 O14727 1/20 0.38
CDC25B P30305 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
KMO O15229 1/20 0.37

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
SCHEMBL21404560 0.80 CREBBP (0.41) MAPTKDM4ESMN1; SMN2CYP1A2ALDH1A1
SCHEMBL789351 0.78 MAPT (0.47) LGMNMAPTLMNAHTTKDM4E
SCHEMBL789720 0.78 LGMN (0.44) LGMNMAPTLMNAHTTKDM4E
SCHEMBL17548072 0.76 LGMN (0.43) LGMNMAPTLMNAHTTKDM4E
SCHEMBL17637634 0.76 LGMN (0.43) LGMNMAPTLMNAHTTKDM4E
SCHEMBL856181 0.76 LMNA (0.46) LGMNMAPTLMNAHTTKDM4E
SCHEMBL29790026 0.76 LMNA (0.46) LGMNMAPTLMNAHTTKDM4E
SCHEMBL13028376 0.75 LGMN (0.43) LGMNMAPTLMNAHTTKDM4E
SCHEMBL791178 0.74 ALDH1A1 (0.47) LGMNMAPTLMNAHTTKDM4E
SCHEMBL30748846 0.74 ALDH1A1 (0.47) LGMNMAPTLMNAHTTKDM4E

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-4630401-A2 CARBONIC ANHYDRASE ENZYME INHIBITORS AND METHODS OF USE THEREOF Rutgers, the State University of New Jersey (US) 2025-10-15 EP disclosed
WO-2024124023-A2 CARBONIC ANHYDRASE ENZYME INHIBITORS AND METHODS OF USE THEREOF RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2024-06-13 WO disclosed