SCHEMBL14435203

SCHEMBL14435203

CO[C@H](C)CN1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LTA4H P09960 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.39
ATM Q13315 1/20 0.39
USP2 O75604 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL6511981 1.00 MEN1 (0.42) MEN1KMT2ALTA4HSMN1; SMN2POLB
SCHEMBL13132269 1.00 MEN1 (0.42) MEN1KMT2ALTA4HSMN1; SMN2POLB
SCHEMBL13547722 0.98 MEN1 (0.46) MEN1KMT2ALTA4HSMN1; SMN2POLB
SCHEMBL23205839 0.98 MEN1 (0.46) MEN1KMT2ALTA4HSMN1; SMN2POLB
SCHEMBL13547720 0.81 POLB (0.45) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL9432545 0.79 TLR9 (0.30)
SCHEMBL12125079 0.79 USP2 (0.50) MEN1KMT2ASMN1; SMN2USP2TSHR
SCHEMBL20349515 0.79 DRD2 (0.33) SMN1; SMN2POLB
SCHEMBL23205826 0.79 USP2 (0.50) MEN1KMT2ASMN1; SMN2USP2TSHR
SCHEMBL18390141 0.79 DRD2 (0.33) SMN1; SMN2POLB

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-2021063346-A1 KRAS G12C INHIBITOR AND APPLICATION THEREOF 上海迪诺医药科技有限公司 2021-04-08 WO disclosed
WO-2007096186-A1 SUBSTITUTED PHENYLPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-08-30 WO disclosed