SCHEMBL27817568

SCHEMBL27817568

NCC=COC(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
F2 P00734 1/20 0.47
TDP1 Q9NUW8 3/20 0.44
TSHR P16473 4/20 0.44
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 2/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 1/20 0.43
HIF1A Q16665 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
TP53 P04637 1/20 0.40
PLA2G7 Q13093 1/20 0.40
PARP10 Q53GL7 1/20 0.40

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
SCHEMBL17459752 0.83 LMNA (0.48) LMNAF2TDP1TSHRALDH1A1
SCHEMBL28182671 0.82 LMNA (0.61) LMNAF2TDP1TSHRALDH1A1
SCHEMBL2434553 0.81 LMNA (0.50) LMNAF2TDP1TSHRALDH1A1
SCHEMBL10500491 0.81 LMNA (0.47) LMNAF2TDP1TSHRALDH1A1
SCHEMBL2434555 0.81 LMNA (0.50) LMNAF2TDP1TSHRALDH1A1
SCHEMBL17459732 0.81 LMNA (0.47) LMNAF2TDP1TSHRALDH1A1
SCHEMBL5351140 0.81 LMNA (0.47) LMNAF2TDP1TSHRALDH1A1
SCHEMBL17459734 0.81 LMNA (0.47) LMNAF2TDP1TSHRALDH1A1
SCHEMBL6673178 0.80 LMNA (0.45) LMNAF2TDP1TSHRALDH1A1
SCHEMBL10540709 0.80 LMNA (0.45) LMNAF2TDP1TSHRALDH1A1

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
CN-102159579-B Tricyclic indole derivatives and methods of use thereof MERCK SHARP & DOHME 2015-03-25 CN disclosed
CN-102159579-A Tricyclic indole derivatives and methods of use thereof SCHERING CORP 2011-08-17 CN disclosed