SCHEMBL1475720

SCHEMBL1475720

O=C(NCCNCc1ccccc1)c1cc(-c2ccco2)on1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.80
ALDH1A1 P00352 9/20 0.80
RAB9A P51151 9/20 0.80
SMN1; SMN2 Q16637 7/20 0.80
HPGD P15428 2/20 0.67
LMNA P02545 2/20 0.67
TP53 P04637 1/20 0.67
GAA P10253 1/20 0.67
HTT P42858 4/20 0.65
KMT2A Q03164 4/20 0.65
MEN1 O00255 3/20 0.65
MAPT P10636 2/20 0.65
MAPK1 P28482 2/20 0.65
KDM4E B2RXH2 2/20 0.62
PKM P14618 1/20 0.62
CTDSP1 Q9GZU7 1/20 0.60
SCD O00767 2/20 0.54
SCD5 Q86SK9 2/20 0.54
HSD17B10 Q99714 1/20 0.53
TSHR P16473 1/20 0.53

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
SCHEMBL1475653 0.89 NPC1 (1.00) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL1474855 0.87 NPC1 (1.00) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL1474512 0.85 ALDH1A1 (0.86) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL1474191 0.83 NPC1 (0.72) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL15190211 0.82 ALDH1A1 (0.57) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL1474842 0.80 ALDH1A1 (0.81) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL1475419 0.80 ALDH1A1 (0.64) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL1477503 0.79 NPC1 (0.69) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL1475066 0.79 NPC1 (0.69) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL1474317 0.79 RAB9A (0.69) NPC1ALDH1A1RAB9ASMN1; SMN2HPGD

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 NPC1 2242/4885ALDH1A1 706/4885RAB9A 2013/4885

“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.