SCHEMBL14324570

SCHEMBL14324570

Cc1ccc2c(c1)Sc1cc(C)c(C(N)=O)c(N)c1N2CC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HSD17B10 Q99714 2/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MEN1 O00255 4/20 0.32
▸ KMT2A Q03164 4/20 0.32
▸ GAA P10253 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ LMNA P02545 3/20 0.31
▸ CISD2 Q8N5K1 1/20 0.31
▸ LPAR1 Q92633 1/20 0.31
▸ LPAR3 Q9UBY5 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ NOX1 Q9Y5S8 1/20 0.30

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
SCHEMBL17484559 0.69 MEN1 (0.62) HTTHSD17B10MEN1KMT2ALMNA
SCHEMBL6308966 0.67 MAPK1 (0.46) MEN1KMT2ALMNAL3MBTL1TP53
SCHEMBL30480968 0.67 MAPK1 (0.46) MEN1KMT2ALMNAL3MBTL1TP53
SCHEMBL17356849 0.64 ALDH1A1 (0.59) HTTHSD17B10SMN1; SMN2MEN1KMT2A
SCHEMBL1926809 0.63 NOX1 (0.44) HSD17B10ALOX15SMN1; SMN2MEN1KMT2A
SCHEMBL1828807 0.63 BCHE (0.37) KMT2AGAAMAPT
SCHEMBL17482013 0.63 MEN1 (0.54) HSD17B10SMN1; SMN2MEN1KMT2AGAA
SCHEMBL13212473 0.63 MAPT (0.48) HTTSMN1; SMN2MEN1KMT2AGAA
SCHEMBL30595091 0.62 MAPK1 (0.58) MEN1KMT2AGAALMNAL3MBTL1
SCHEMBL17356858 0.60 MAPT (0.51) HTTTSHRHSD17B10ALOX15MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8999124-B2 Detection device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2015-04-07 — — US disclosed
EP-2543981-A1 DETECTION DEVICE Nippon Kayaku Kabushiki Kaisha (JP) 2013-01-09 — — EP disclosed
US-20120325658-A1 DETECTION DEVICE NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-27 — — US disclosed
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