SCHEMBL13655734

SCHEMBL13655734

COBN1CC=CC1(C)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
PAX8 Q06710 1/20 0.31
MCL1 Q07820 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30

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
SCHEMBL13655732 0.69 SMN1; SMN2 (0.32) MEN1KMT2ASMN1; SMN2
SCHEMBL13655884 0.67 BACE1 (0.35) MEN1KMT2AALDH1A1LMNAMMP2
SCHEMBL4062459 0.66 MAPK1 (0.51) MAPK1MEN1KMT2AALDH1A1CYP3A4
SCHEMBL14095715 0.64 MAPK1 (0.36) MAPK1MEN1KMT2AALDH1A1LMNA
SCHEMBL27607791 0.62 MAPK1 (0.38) MAPK1MEN1KMT2AALDH1A1CYP3A4
SCHEMBL4057796 0.62 MAPK1 (0.43) MAPK1MEN1KMT2AALDH1A1CYP3A4
SCHEMBL14345917 0.57 OPRM1 (0.35) MEN1KMT2A
SCHEMBL13645553 0.55 ALDH1A1 (0.39) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL2350335 0.55 LMNA (0.42) MEN1KMT2AALDH1A1LMNAGAA
SCHEMBL11064104 0.53 ALDH1A1 (0.46) MEN1KMT2AALDH1A1LMNAGAA

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-1515724-B1 MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2009-10-21 EP disclosed