SCHEMBL29047019

SCHEMBL29047019

O=C1c2ccccc2C(=O)N1CCO.[NaH]

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HEXA P06865 1/20 0.67
HEXB P07686 1/20 0.67
KDM4E B2RXH2 3/20 0.63
GLS O94925 1/20 0.59
CA12 O43570 1/20 0.53
CA9 Q16790 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 1/20 0.50
RGS12 O14924 1/20 0.50
LMNA P02545 1/20 0.50
PABPC1 P11940 1/20 0.50
HTT P42858 1/20 0.50
RECQL P46063 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
SCHEMBL64902 0.98 HEXA (0.69) HEXAHEXBKDM4EGLSCA12
SCHEMBL29514557 0.98 HEXA (0.69) HEXAHEXBKDM4EGLSCA12
SCHEMBL15057224 0.98 HEXA (0.69) HEXAHEXBKDM4EGLSCA12
Hydrochloric Acid SCHEMBL28883118 0.96 HEXA (0.67) HEXAHEXBKDM4EGLSCA12
SCHEMBL29459619 0.85 KDM4E (0.68) KDM4EGLSSMN1; SMN2NPC1RAB9A
SCHEMBL526807 0.85 KDM4E (0.68) KDM4EGLSSMN1; SMN2NPC1RAB9A
SCHEMBL5151510 0.84 HEXA (0.54) HEXAHEXBKDM4EGLSCA12
SCHEMBL22448305 0.84 HEXA (0.54) HEXAHEXBKDM4EGLSCA12
SCHEMBL6699936 0.84 GLS (0.71) GLSCA12CA9SMN1; SMN2NPC1
SCHEMBL2554681 0.83 KDM4E (0.72) KDM4ESMN1; SMN2NPC1RAB9AALDH1A1

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
CN-115299253-B Salt-tolerant small-seedling-age tomato grafting seedling raising method 凯盛浩丰农业有限公司 2023-08-04 CN disclosed