SCHEMBL19202322

SCHEMBL19202322

O=C(O)c1cc2cccc(I)c2c(O)c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
GPR35 Q9HC97 1/20 0.45
GRIN2D O15399 1/20 0.45
GRIN2A Q12879 1/20 0.45
GRIN2B Q13224 1/20 0.45
GRIN2C Q14957 1/20 0.45
CYP2D6 P10635 1/20 0.43
HSD17B10 Q99714 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MAOA P21397 1/20 0.41
IDO1 P14902 2/20 0.41
TP53 P04637 2/20 0.41
THRB P10828 2/20 0.40
HPGD P15428 2/20 0.40
LDHA P00338 1/20 0.40

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
SCHEMBL27603869 0.84 HSD17B10 (0.55) POLBGPR35GRIN2DGRIN2AGRIN2B
SCHEMBL30118104 0.79 CDC25B (0.47) GRIN2DGRIN2AGRIN2BGRIN2CHSD17B10
SCHEMBL23409342 0.79 CDC25B (0.47) GRIN2DGRIN2AGRIN2BGRIN2CHSD17B10
SCHEMBL19203140 0.79 HSD17B10 (0.55) POLBGPR35GRIN2DGRIN2AGRIN2B
SCHEMBL19202321 0.78 CA12 (0.42) POLBGPR35GRIN2DGRIN2AGRIN2B
SCHEMBL19202240 0.76 ALDH1A1 (0.58) POLBHSD17B10MEN1KMT2AKDM4E
SCHEMBL1619337 0.76 HSD17B10 (0.64) HSD17B10MEN1KMT2ATSHRKDM4E
SCHEMBL29937467 0.76 HSD17B10 (0.64) HSD17B10MEN1KMT2ATSHRKDM4E
SCHEMBL19196110 0.76 CA2 (0.44) POLBGPR35GRIN2DGRIN2AGRIN2B
SCHEMBL19201818 0.75 MEN1 (0.45) POLBGRIN2DGRIN2AGRIN2BGRIN2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017132463-A1 SURFACE PRIMER COMPOSITIONS AND METHODS OF USE ACatechol, Inc. (US) 2017-08-03 WO disclosed