SCHEMBL7318543

SCHEMBL7318543

COc1ccc(CN(C)C(=O)CCC(=O)N2CSC[C@H]2C=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.47
ALDH1A1 P00352 3/20 0.47
HTT P42858 2/20 0.47
TDP1 Q9NUW8 1/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
MAPK1 P28482 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HSP90AA1 P07900 1/20 0.38
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37
CCR1 P32246 1/20 0.37
MAPT P10636 1/20 0.37
ALOX5 P09917 1/20 0.37
POLB P06746 1/20 0.37
NOD2 Q9HC29 1/20 0.37
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL7319239 0.88 NPC1 (0.41) ALDH1A1HTTMEN1KMT2ANPC1
SCHEMBL7321024 0.87 RAB9A (0.46) SMN1; SMN2ALDH1A1HTTKMT2ANPC1
SCHEMBL7316351 0.87 NPC1 (0.55) SMN1; SMN2ALDH1A1MAPK1MEN1KMT2A
SCHEMBL10584481 0.84 NPC1 (0.38) MEN1KMT2ANPC1RAB9ACCR1
SCHEMBL7318507 0.84 NPC1 (0.40) MEN1KMT2ANPC1RAB9ASIGMAR1
SCHEMBL7267087 0.82 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1HTTTDP1BCHE
SCHEMBL7321829 0.80 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ANPC1TSHR
SCHEMBL7322701 0.76 METAP2 (0.40) ALDH1A1MEN1KMT2AMAPTSIGMAR1
SCHEMBL7318668 0.73 CNR2 (0.42) SMN1; SMN2ALDH1A1HTTMEN1KMT2A
SCHEMBL7316425 0.73 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1HTTMEN1KMT2A

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
EP-0280956-B1 THIAZOLIDINE DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1992-10-21 EP claimed
US-4857537-A PREVENTING AMNESIA ONO PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 US claimed
EP-0280956-A1 Thiazolidine derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1988-09-07 EP claimed