SCHEMBL11633339

SCHEMBL11633339

CCCCCC(=O)N(C)c1c(I)c(C(=O)O)c(I)c(N2C(=O)CCCC2=O)c1I

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
LMNA P02545 5/20 0.33
MAPT P10636 5/20 0.33
HPGD P15428 5/20 0.33
HSP90AA1 P07900 5/20 0.33
HTT P42858 3/20 0.33
USP2 O75604 2/20 0.33
APOBEC3G Q9HC16 1/20 0.33
HSD17B10 Q99714 3/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
KDM4E B2RXH2 2/20 0.30
MEN1 O00255 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30
PKM P14618 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
SCHEMBL11636623 0.79 ELANE (0.31)
SCHEMBL11629293 0.75 ALDH1A1 (0.34) ALDH1A1HSD17B10TSHRKMT2ACNR1
SCHEMBL11629419 0.68
SCHEMBL11630987 0.68 TSHR (0.43) ALDH1A1HSD17B10TSHRKMT2AMEN1
SCHEMBL11633830 0.68 CA12 (0.40)
SCHEMBL11630620 0.66 KMT2A (0.35) KMT2A
SCHEMBL11632772 0.64
SCHEMBL11275798 0.59 HSD17B10 (0.32) ALDH1A1MAPTHPGDHSD17B10SMN1; SMN2
SCHEMBL22661231 0.57 MEN1 (0.32) ALDH1A1LMNAHSD17B10KMT2AMEN1
Cyclohexanone SCHEMBL28189926 0.56 ALDH1A1 (0.55) ALDH1A1HSD17B10TSHRKMT2AMEN1

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-4111937-A IODINATED ANILIC ACIDS STERLING DRUG INC. (US) 1978-09-05 US disclosed
US-4031088-A Iodinated anilic acids STERLING DRUG INC. (US) 1977-06-21 US disclosed