SCHEMBL11535110

SCHEMBL11535110

Cc1nnsc1C(=O)OCc1ccc(Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.64
LMNA P02545 2/20 0.54
GAA P10253 1/20 0.47
POLB P06746 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
THRB P10828 1/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
ALDH1A1 P00352 1/20 0.45
NR2F2 P24468 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL18924216 0.86 TSHR (0.56) MAPTLMNAGAAPOLBTHRB
SCHEMBL10335263 0.82 HTT (0.49) MAPTLMNAGAAPOLBL3MBTL1
SCHEMBL574894 0.79 L3MBTL1 (0.42) MAPTLMNAL3MBTL1THRBKMT2A
SCHEMBL2211256 0.75 MAPT (0.54) MAPTLMNAGAAPOLBTHRB
SCHEMBL11536912 0.75 LMNA (0.61) MAPTLMNAGAAPOLBKMT2A
SCHEMBL20267448 0.71 MAPT (0.50) MAPTLMNAGAAPOLBTHRB
SCHEMBL14964147 0.71 NAAA (0.40) MAPTLMNAPOLBL3MBTL1KMT2A
SCHEMBL14404822 0.70 MAPT (0.67) MAPTLMNAGAAL3MBTL1KMT2A
4-Chloroaniline SCHEMBL11573070 0.70 MAPT (0.57) MAPTLMNAGAAPOLBTHRB
SCHEMBL2867253 0.69 ABCC8 (0.50) MAPTLMNAPOLBL3MBTL1KMT2A

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-4177054-A PREEMERGENT AND POSTEMERGENT SCHERING AKTIENGESELLSCHAFT (DE) 1979-12-04 US disclosed