SCHEMBL9348556

SCHEMBL9348556

CCCCOCCNC(=O)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.76
NAAA Q02083 1/20 0.67
MAPT P10636 2/20 0.61
GAA P10253 1/20 0.61
NPC1 O15118 3/20 0.60
RAB9A P51151 3/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
HPGD P15428 3/20 0.59
TSHR P16473 2/20 0.56
NAMPT P43490 1/20 0.55
RECQL P46063 1/20 0.55
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 1/20 0.53
NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL1959872 0.95 SMN1; SMN2 (0.73) SMN1; SMN2NAAAMAPTGAANPC1
SCHEMBL12445445 0.90 SMN1; SMN2 (0.81) SMN1; SMN2NAAAMAPTGAANPC1
SCHEMBL16361209 0.89 SMN1; SMN2 (0.84) SMN1; SMN2NAAAMAPTGAANPC1
SCHEMBL25970084 0.88 SMN1; SMN2 (0.96) SMN1; SMN2NAAAGAANPC1RAB9A
SCHEMBL4354408 0.88 NAAA (0.67) SMN1; SMN2NAAAMAPTGAANPC1
SCHEMBL20734830 0.87 SMN1; SMN2 (1.00) SMN1; SMN2NAAAGAANPC1RAB9A
SCHEMBL731383 0.85 SMN1; SMN2 (0.77) SMN1; SMN2NAAAMAPTGAANPC1
SCHEMBL30910449 0.84 SMN1; SMN2 (0.87) SMN1; SMN2NAAANPC1RAB9AHPGD
SCHEMBL15577818 0.84 SMN1; SMN2 (0.87) SMN1; SMN2NAAANPC1RAB9AHPGD
SCHEMBL8404704 0.84 SMN1; SMN2 (0.60) SMN1; SMN2MAPTGAANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488032-B1 PROSTAGLANDIN TRANSPORTER INHIBITORS AND USES THEREOF EINSTEIN COLL MED (US) 2016-11-02 EP disclosed
WO-2011037610-A1 PROSTAGLANDIN TRANSPORTER INHIBITORS AND USES THEREOF ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2011-03-31 WO disclosed
EP-0357409-B1 Heat-sensitive recording material FUJI PHOTO FILM CO LTD (JP) 1994-07-20 EP disclosed
US-4994431-A Containing colorless dye precursor, color developer and 1-alkoxy-phenoxy-2-aryloxypropane sensitizer; preservation stability, high sensitivity FUJI PHOTO FILM CO., LTD. (JP) 1991-02-19 US disclosed
EP-0357409-A2 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1990-03-07 EP disclosed