SCHEMBL7960299

SCHEMBL7960299

Cc1cc(CC(=O)C(=O)S)oc1C

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 2/20 0.36
TTR P02766 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GLA P06280 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
PTGER4 P35408 1/20 0.32
ALPG P10696 1/20 0.32
KMT2A Q03164 1/20 0.31
ALPL P05186 1/20 0.31
KDM4E B2RXH2 2/20 0.30
MAPT P10636 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
SCHEMBL7958414 0.79 PTGER4 (0.47) APEX1TTRTAS1R3TAS1R1POLB
SCHEMBL9768897 0.74 TAS1R3 (0.35) APEX1TTRTAS1R3TAS1R1POLB
SCHEMBL7960304 0.73 APEX1 (0.38) APEX1TTRTAS1R3TAS1R1POLB
SCHEMBL2030407 0.71 NPSR1 (0.39) APEX1TTRSMN1; SMN2GLANPC1
SCHEMBL4301123 0.69
SCHEMBL7959726 0.68 ELANE (0.53) POLBL3MBTL1SMN1; SMN2NPC1ALDH1A1
SCHEMBL3906982 0.65
SCHEMBL3922006 0.63 TLR8 (0.37) APEX1TAS1R3TAS1R1POLBSMN1; SMN2
SCHEMBL13680860 0.62 MAPT (0.32) APEX1TTRSMN1; SMN2MAPT
SCHEMBL6807398 0.62 ALDH1A1 (0.46) POLBL3MBTL1ALDH1A1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6184245-B1 Cyclic ketone derivatives and their medical applications TORAY INDUSTRIES INC. (JP) 2001-02-06 US disclosed
EP-0962456-A1 CYCLIC KETONE DERIVATIVE AND PHARMACEUTICAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1999-12-08 EP disclosed