SCHEMBL11023401

SCHEMBL11023401

O=C1CC(c2ccc(C(=O)O)cc2)=NO1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.62
CRBN Q96SW2 1/20 0.44
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
BCL2L1 Q07817 1/20 0.40
BAD Q92934 1/20 0.40
HPGD P15428 1/20 0.40
TDP2 O95551 1/20 0.38
SRD5A2 P31213 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
MKNK2 Q9HBH9 1/20 0.38
RXRA P19793 2/20 0.37
RXRB P28702 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SORT1 Q99523 1/20 0.37
CA12 O43570 3/20 0.36
CA1 P00915 3/20 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
SCHEMBL1499925 0.70 CRBN (0.45) CRBNTP53TSHRNPC1RAB9A
SCHEMBL12402426 0.69 AXL (0.66) CRBNTP53TSHRNPC1RAB9A
SCHEMBL11717156 0.68 NOTUM (0.56) NOTUMTP53ALDH1A1SORT1
SCHEMBL2637326 0.67 TSHR (0.80) TP53TSHRBCL2L1BADSRD5A2
SCHEMBL14018385 0.67 TSHR (0.80) TP53TSHRBCL2L1BADSRD5A2
SCHEMBL69873 0.67 TSHR (0.80) TP53TSHRBCL2L1BADSRD5A2
Terephthalic Acid SCHEMBL9577834 0.67 TSHR (0.80) TP53TSHRBCL2L1BADSRD5A2
SCHEMBL21808797 0.65 TSHR (0.75) TP53TSHRBCL2L1BADSRD5A2
SCHEMBL6667036 0.65 TSHR (0.75) TP53TSHRBCL2L1BADSRD5A2
Fluoride SCHEMBL20513068 0.65 TSHR (0.75) TP53TSHRBCL2L1BADSRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0048834-B1 METHOD FOR MEASUREMENT OF TRACE ENZYMES FUJI PHOTO FILM CO., LTD. (JP) 1985-06-19 EP disclosed
EP-0047470-B1 METHOD FOR IMMUNOCHEMICAL MEASUREMENT FUJI PHOTO FILM CO., LTD. (JP) 1985-04-24 EP disclosed
US-4473652-A LABELLING WITH CYANINE OR MEROCYANINE DYE FUJI PHOTO FILM CO., LTD. (JP) 1984-09-25 US disclosed
US-4414325-A PHOTOGRAPHY FUJI PHOTO FILM CO., LTD. (JP) 1983-11-08 US disclosed
EP-0048834-A1 Method for measurement of trace enzymes FUJI PHOTO FILM CO., LTD. (JP) 1982-04-07 EP disclosed
EP-0047470-A1 Method for immunochemical measurement FUJI PHOTO FILM CO., LTD. (JP) 1982-03-17 EP disclosed