SCHEMBL6684516

SCHEMBL6684516

C1=C(Cc2ccccc2)OCCOCCOCCOCCO1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
LMNA P02545 3/20 0.41
CRHBP P24387 2/20 0.41
CRHR2 Q13324 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
CALM1 P0DP23 1/20 0.38
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HPGD P15428 1/20 0.35
LTA4H P09960 1/20 0.35
HSD17B10 Q99714 1/20 0.35
POLB P06746 1/20 0.34
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL182272 0.77 CALM1 (0.44) NPC1RAB9ALMNASMN1; SMN2CALM1
Diphenylmethane SCHEMBL28948706 0.73 CALM1 (0.71) RAB9ALMNACRHBPCRHR2SMN1; SMN2
SCHEMBL11773154 0.70 HTR2C (0.36) NPC1RAB9ALMNACRHBPCRHR2
SCHEMBL3394136 0.69 CALM1 (0.44) NPC1RAB9ALMNASMN1; SMN2CALM1
SCHEMBL3242827 0.68 CALM1 (0.52) NPC1RAB9ALMNACRHBPCRHR2
SCHEMBL7723121 0.67 CALM1 (0.58) NPC1RAB9ASMN1; SMN2CALM1KDM4E
SCHEMBL3393010 0.66 CALM1 (0.44) NPC1RAB9ALMNASMN1; SMN2CALM1
SCHEMBL30583089 0.63 CALM1 (0.52) RAB9ASMN1; SMN2CALM1TDP1ALDH1A1
Benzyl Alcohol SCHEMBL7854591 0.63 TSHR (0.70) LMNACRHBPCRHR2SMN1; SMN2HTT
SCHEMBL31722987 0.63 CALM1 (0.37) NPC1RAB9ALMNASMN1; SMN2CALM1

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
EP-1457541-A1 WATER ABSORBING AGENT, PROCESS FOR ITS PRODUCTION, AND ABSORBERS AND ABSORBENT ARTICLES MADE BY USING THE AGENT San-Dia Polymers, Ltd. (JP) 2004-09-15 EP disclosed