SCHEMBL27935752

SCHEMBL27935752

CCOC(=O)Cc1ccc(Cl)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.50
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 5/20 0.47
RAB9A P51151 2/20 0.47
HTT P42858 1/20 0.47
TSHR P16473 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
HPGD P15428 3/20 0.40
POLB P06746 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
CASP1 P29466 1/20 0.40
KAT2B Q92831 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
SCHEMBL16564364 0.83 SMN1; SMN2 (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL16563690 0.82 SMN1; SMN2 (0.53) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL16564352 0.82 SMN1; SMN2 (0.53) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL28736805 0.82 KMT2A (0.46) SMN1; SMN2KMT2AMEN1ALDH1A1RAB9A
SCHEMBL13141342 0.81 SMN1; SMN2 (0.51) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL12727389 0.80 ALDH1A1 (0.42) SMN1; SMN2KMT2AMEN1ALDH1A1RAB9A
SCHEMBL24614582 0.79 SMN1; SMN2 (0.58) SMN1; SMN2KMT2AMEN1ALDH1A1RAB9A
SCHEMBL10316436 0.79 SMN1; SMN2 (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1RAB9A
SCHEMBL5582083 0.79 SMN1; SMN2 (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1TSHR
SCHEMBL16714140 0.79 SMN1; SMN2 (0.50) SMN1; SMN2KMT2AMEN1ALDH1A1RAB9A

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
CN-101815713-B Polycyclic compounds EISAI R&D MAN CO LTD 2013-09-11 CN disclosed