SCHEMBL24521472

SCHEMBL24521472

CNCC(=O)N1CCC(N(C)CC(=O)N2CCCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 2/20 0.40
ATM Q13315 1/20 0.39
MAPT P10636 1/20 0.37
DPP4 P27487 2/20 0.37
EPHX2 P34913 2/20 0.36
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.35
WNT3 P56703 1/20 0.35
SFRP1 Q8N474 1/20 0.35
KDM4E B2RXH2 1/20 0.35
KDM1A O60341 2/20 0.34
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34

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
SCHEMBL18909244 0.83 EPHX2 (0.49) KMT2AALDH1A1SMN1; SMN2ATMEPHX2
SCHEMBL21281206 0.83 NPC1 (0.41) KMT2AALDH1A1SMN1; SMN2LMNAATM
SCHEMBL19444620 0.82 KMT2A (0.47) KMT2AALDH1A1SMN1; SMN2LMNAATM
SCHEMBL19444608 0.82 KMT2A (0.47) KMT2AALDH1A1SMN1; SMN2LMNAATM
SCHEMBL24521422 0.82 CPN1 (0.40) KMT2AALDH1A1SMN1; SMN2LMNAATM
SCHEMBL21281128 0.80 EPHX2 (0.49) KMT2AALDH1A1SMN1; SMN2LMNAEPHX2
SCHEMBL30098883 0.80 LMNA (0.41) KMT2AALDH1A1SMN1; SMN2LMNAATM
SCHEMBL22030873 0.79 CYP3A4 (0.41) KMT2AALDH1A1SMN1; SMN2LMNAATM
SCHEMBL24244796 0.79 CPN1 (0.40) KMT2AALDH1A1SMN1; SMN2LMNADPP4
SCHEMBL1226363 0.79 ATM (0.50) KMT2AALDH1A1SMN1; SMN2ATMDPP4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3596072-B1 PYRAZOLOCHLOROPHENYL COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF HOFFMANN LA ROCHE (CH) 2022-06-22 EP disclosed