SCHEMBL11807828

SCHEMBL11807828

CCOC(=O)c1cccc2c3ccc(Cl)c(C)c3n(Cc3ccccc3)c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
FABP4 P15090 3/20 0.52
MAPT P10636 4/20 0.47
ALOX5 P09917 1/20 0.47
THRB P10828 1/20 0.47
ALDH1A1 P00352 2/20 0.45
MAPK1 P28482 1/20 0.45
CDC25B P30305 2/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
S1PR3 Q99500 1/20 0.43
TDP2 O95551 1/20 0.43
NSD2 O96028 1/20 0.43
PLCG1 P19174 1/20 0.43
PAX8 Q06710 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL11741187 0.87 FABP4 (0.68) FABP4MAPTALDH1A1LMNAKDM4E
SCHEMBL11817704 0.82 TSHR (0.46) TSHRMAPTTHRBALDH1A1MAPK1
SCHEMBL8388243 0.79 TSHR (0.54) TSHRFABP4MAPTALOX5ALDH1A1
SCHEMBL8180699 0.74 TSHR (0.60) TSHRFABP4MAPTALDH1A1MAPK1
SCHEMBL2601348 0.71 TSHR (0.63) TSHRMAPTALDH1A1MAPK1CDC25B
SCHEMBL8802010 0.71 TSHR (0.50) TSHRMAPTALOX5ALDH1A1MAPK1
SCHEMBL17625298 0.69 F10 (0.58) TSHRMAPTALDH1A1MAPK1LMNA
SCHEMBL7426624 0.69 TSHR (0.50) TSHRALDH1A1LMNAKDM4EGAA
SCHEMBL23174424 0.69 TSHR (0.62) TSHRMAPTALDH1A1MAPK1LMNA
SCHEMBL5749832 0.69 TSHR (0.59) TSHRALDH1A1CDC25BKDM4EMEN1

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
US-3956295-A ANTIINFLAMMATORY SCHERING AKTIENGESELLSCHAFT (DT) 1976-05-11 US claimed