SCHEMBL8896400

SCHEMBL8896400

[CH2]C(=O)OCCCCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.61
SMN1; SMN2 Q16637 3/20 0.54
NPC1 O15118 1/20 0.54
RECQL P46063 1/20 0.54
RAB9A P51151 1/20 0.54
FFAR1 O14842 1/20 0.53
TDP1 Q9NUW8 2/20 0.52
MAPT P10636 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
HDAC3 O15379 1/20 0.50
MAPK1 P28482 1/20 0.50
ADRA1A P35348 1/20 0.50
HDAC4 P56524 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50

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
SCHEMBL8895862 0.98 LMNA (0.59) LMNASMN1; SMN2NPC1RECQLRAB9A
SCHEMBL6972131 0.94 LMNA (0.68) LMNASMN1; SMN2NPC1RECQLRAB9A
SCHEMBL3364047 0.86 HCAR2 (0.58) LMNASMN1; SMN2NPC1RECQLRAB9A
SCHEMBL982156 0.85 LMNA (0.65) LMNASMN1; SMN2NPC1RECQLRAB9A
SCHEMBL1553490 0.85 LMNA (0.65) LMNASMN1; SMN2NPC1RECQLRAB9A
SCHEMBL21681731 0.83 LMNA (0.62) LMNASMN1; SMN2NPC1RECQLRAB9A
SCHEMBL21681730 0.83 LMNA (0.62) LMNASMN1; SMN2NPC1RECQLRAB9A
SCHEMBL1836828 0.83 LMNA (0.62) LMNASMN1; SMN2NPC1RECQLRAB9A
SCHEMBL21681727 0.83 LMNA (0.62) LMNASMN1; SMN2NPC1RECQLRAB9A
SCHEMBL21681726 0.83 LMNA (0.62) LMNASMN1; SMN2NPC1RECQLRAB9A

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-5670563-A ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND CIBA-SPECIALTY CHEMICALS CORPORATION (US) 1997-09-23 US disclosed