SCHEMBL25146239

SCHEMBL25146239

Cc1nn(C)c(Cl)c1CN1CCNCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.46
ATM Q13315 1/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 3/20 0.45
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
CXCR4 P61073 2/20 0.38
SMO Q99835 1/20 0.38
LMNA P02545 1/20 0.37
NMT1 P30419 1/20 0.36
PTPN11 Q06124 3/20 0.36
MEN1 O00255 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
ADRA2C P18825 1/20 0.36
CCR2 P41597 1/20 0.36
CXCL12 P48061 1/20 0.36
BLM P54132 1/20 0.36

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
SCHEMBL13184133 0.81 SIGMAR1 (0.39) SMN1; SMN2KMT2AKDM4ESIGMAR1CXCR4
SCHEMBL14375238 0.79 L3MBTL1 (0.51) L3MBTL1ATMALDH1A1SMN1; SMN2KMT2A
SCHEMBL15330672 0.75 L3MBTL1 (0.47) L3MBTL1ATMALDH1A1SMN1; SMN2KMT2A
SCHEMBL16200399 0.74 SIGMAR1 (0.39) KMT2APOLBSIGMAR1CXCR4LMNA
SCHEMBL17339934 0.69 NMT1 (0.41) L3MBTL1ATMALDH1A1SMN1; SMN2KMT2A
SCHEMBL14859461 0.69 GAA (0.57) ALDH1A1KMT2ASIGMAR1CXCR4LMNA
SCHEMBL20138104 0.69 L3MBTL1 (0.39) L3MBTL1ATMALDH1A1SMN1; SMN2KMT2A
SCHEMBL8361532 0.69 L3MBTL1 (0.39) L3MBTL1ATMALDH1A1SMN1; SMN2KMT2A
SCHEMBL16200226 0.69 SIGMAR1 (0.40) KMT2ASIGMAR1CXCR4LMNAPTPN11
SCHEMBL15330289 0.68 L3MBTL1 (0.52) L3MBTL1ATMALDH1A1SMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024088922-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF MONOACYLGLYCEROL LIPASE (MAGL) F. HOFFMANN-LA ROCHE AG (CH) 2024-05-02 WO disclosed
WO-2023144160-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-03 WO disclosed
WO-2023062049-A1 HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-04-20 WO disclosed