SCHEMBL1474317

SCHEMBL1474317

O=C(NCCOc1ccccc1)c1cc(-c2ccco2)on1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.69
NPC1 O15118 11/20 0.69
SMN1; SMN2 Q16637 9/20 0.69
ALDH1A1 P00352 9/20 0.69
HPGD P15428 4/20 0.67
LMNA P02545 2/20 0.67
TP53 P04637 2/20 0.67
GAA P10253 1/20 0.67
HTT P42858 4/20 0.59
MAPT P10636 2/20 0.57
TSHR P16473 1/20 0.56
KMT2A Q03164 6/20 0.56
MEN1 O00255 4/20 0.56
MAPK1 P28482 1/20 0.56
CYP1A2 P05177 1/20 0.55
CYP2C19 P33261 1/20 0.55
KDM4E B2RXH2 1/20 0.54
PKM P14618 1/20 0.54
PLA2G1B P04054 1/20 0.51
ATG4B Q9Y4P1 1/20 0.51

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
SCHEMBL16373568 0.85 RAB9A (0.77) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL1178617 0.85 ALDH1A1 (0.63) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL15190362 0.83 NPC1 (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL1474855 0.82 NPC1 (1.00) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL1474191 0.81 NPC1 (0.72) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL1475400 0.81 RAB9A (0.75) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL17661427 0.81 HDAC6 (0.65) RAB9ANPC1SMN1; SMN2HPGDLMNA
SCHEMBL1474512 0.80 ALDH1A1 (0.86) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL1475653 0.79 NPC1 (1.00) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL1477503 0.79 NPC1 (0.69) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1971600-B1 ISOXAZOLE DERIVATIVES AND USE THEREOF SK BIOPHARMACEUTICALS CO LTD (KR) 2013-08-21 EP disclosed
US-7915297-B2 Isoxazole derivatives and use thereof SK HOLDINGS CO., LTD. (KR) 2011-03-29 US disclosed
US-7915297-B2 Isoxazole derivatives and use thereof SK HOLDINGS CO., LTD. (KR) 2011-03-29 US disclosed
US-7915297-B2 Isoxazole derivatives and use thereof SK HOLDINGS CO., LTD. (KR) 2011-03-29 US disclosed
US-20090131336-A1 Isoxazole Derivatives and Use Thereof SK BIOPHARMACEUTICALS CO., LTD. (KR) 2009-05-21 US disclosed
US-20090131336-A1 Isoxazole Derivatives and Use Thereof SK BIOPHARMACEUTICALS CO., LTD. (KR) 2009-05-21 US disclosed
WO-2007078113-A1 ISOXAZOLE DERIVATIVES AND USE THEREOF SK HOLDINGS CO., LTD. (KR) 2007-07-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090131336-A1 Isoxazole Derivatives and Use Thereof WNT3A, WNT1, WNT3 RAB9A 2013/4885NPC1 2242/4885SMN1; SMN2 3980/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.