SCHEMBL6819151

SCHEMBL6819151

CCN(c1ccc(OCc2ccc(C(=O)O)o2)cc1)S(=O)(=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.59
RAB9A P51151 9/20 0.59
POLB P06746 4/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
KMT2A Q03164 3/20 0.59
MAPK1 P28482 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
HSD17B10 Q99714 1/20 0.53
KDM4E B2RXH2 1/20 0.53
NR1I2 O75469 1/20 0.51
TSHR P16473 1/20 0.51
HSP90AA1 P07900 2/20 0.50
ESR1 P03372 1/20 0.49
PTPN1 P18031 1/20 0.48
PTPN12 Q05209 1/20 0.48
PTPN22 Q9Y2R2 1/20 0.48

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
SCHEMBL6813747 0.91 KMT2A (0.61) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL6814232 0.85 NPC1 (0.59) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL6815339 0.77 POLB (0.77) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL6814464 0.76 KMT2A (0.61) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL6814497 0.76 POLB (0.75) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL6811138 0.75 AR (0.64) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL6810773 0.74 POLB (0.73) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL1756442 0.74 POLB (0.73) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL6815374 0.74 POLB (0.73) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL6810769 0.73 POLB (0.81) NPC1RAB9APOLBSMN1; SMN2KMT2A

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
WO-2004012656-A2 THIOPHENE AND FURAN DERIVATIVES AS PROSTAGLANDIN AGONISTS AND USE THEREOF APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2004-02-12 WO claimed
WO-2004012656-A2 THIOPHENE AND FURAN DERIVATIVES AS PROSTAGLANDIN AGONISTS AND USE THEREOF APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2004-02-12 WO disclosed