SCHEMBL8398451

SCHEMBL8398451

CCNCC(=O)Nc1c(C)cc(O)cc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.45
LMNA P02545 3/20 0.45
HPGD P15428 3/20 0.44
POLB P06746 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 2/20 0.41
PKM P14618 1/20 0.41
ALOX15 P16050 2/20 0.41
RAB9A P51151 1/20 0.41
GAA P10253 1/20 0.40
TP53 P04637 1/20 0.40
ALDH1A1 P00352 4/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 2/20 0.38
SCN3A Q9NY46 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
MC4R P32245 1/20 0.38
SCN4A P35499 1/20 0.38

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
SCHEMBL24022445 0.82 ALDH1A1 (0.55) TERTLMNAHPGDPOLBMEN1
SCHEMBL4955344 0.82 S1PR4 (0.43) TERTLMNAHPGDPOLBMEN1
SCHEMBL1232491 0.81 MAPT (0.58) LMNAPOLBMEN1KMT2APKM
SCHEMBL25620098 0.77 ALDH1A1 (0.59) LMNAHPGDKMT2ATSHRALOX15
SCHEMBL24849174 0.77 LMNA (0.49) LMNAHPGDPOLBMEN1KMT2A
SCHEMBL11723023 0.76 ALDH1A1 (0.54) HPGDPOLBMEN1KMT2ATSHR
SCHEMBL7124281 0.76 TERT (0.42) TERTLMNAPOLBMEN1KMT2A
SCHEMBL11723693 0.75 HPGD (0.51) LMNAHPGDKMT2ATSHRRAB9A
SCHEMBL28829667 0.75 LMNA (0.51) LMNAHPGDPOLBMEN1KMT2A
SCHEMBL21261833 0.75 HPGD (0.77) LMNAHPGDMEN1KMT2ATSHR

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
EP-0915834-A1 METHOD AND COMPOSITIONS FOR PRODUCING ANALGESIA ELAN PHARMACEUTICALS, INC. (US) 1999-05-19 EP disclosed
WO-1997033860-A1 METHOD AND COMPOSITIONS FOR PRODUCING ANALGESIA NEUREX CORPORATION (US) 1997-09-18 WO disclosed