SCHEMBL31662285

SCHEMBL31662285

Cn1ncc2cc(C(N)=O)c(Oc3ccc(OCC(=O)N4CCOCC4)cc3)cc21

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 10/20 0.50
POLB P06746 1/20 0.50
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HPGD P15428 2/20 0.47
USP2 O75604 1/20 0.47
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
PARP1 P09874 1/20 0.43
SCN7A Q01118 1/20 0.43
KCNH2 Q12809 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL31661959 0.91 GAA (0.52) FKBP1APOLBALDH1A1SMN1; SMN2HPGD
SCHEMBL31662229 0.85 HRH3 (0.47) ALDH1A1USP2LMNAPARP1KCNH2
SCHEMBL31662421 0.83 MCL1 (0.44) KDM4E
SCHEMBL31661981 0.82 JAK1 (0.43) POLBHPGDLMNAHTTRAB9A
SCHEMBL31662140 0.82 GAA (0.46) FKBP1APOLBSMN1; SMN2HPGDUSP2
SCHEMBL31661991 0.81 DRD2 (0.41) POLB
SCHEMBL31662042 0.80 IRAK4 (0.41)
SCHEMBL31662453 0.79 MKNK1 (0.39)
SCHEMBL31662483 0.79 SYK (0.41)
SCHEMBL31662511 0.78 SYK (0.38) KDM4ELMNA

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
WO-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO claimed
WO-2025149545-A1 HETEROARYLPHENYL ETHER DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-07-17 WO disclosed