SCHEMBL11064308

SCHEMBL11064308

[CH2]CCCCC(=O)c1ccc[nH]1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
RAB9A P51151 7/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
NPC1 O15118 4/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
HSD17B10 Q99714 1/20 0.53
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.42

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
SCHEMBL14436880 0.82 TSHR (0.84) TSHRRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL7464870 0.82 TSHR (0.61) TSHRRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL7083571 0.82 TSHR (0.61) TSHRRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL9049759 0.81 TSHR (0.59) TSHRRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL21061174 0.81 TSHR (0.59) TSHRRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL16516272 0.81 TSHR (0.59) TSHRRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL9150872 0.81 TSHR (0.59) TSHRRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL30807225 0.80 TSHR (0.62) TSHRRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL10975814 0.80 TSHR (0.62) TSHRRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL9751717 0.79 TSHR (0.57) TSHRRAB9ASMN1; SMN2NPC1MEN1

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
US-4435404-A ANTICOAGULANTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-03-06 US disclosed