SCHEMBL1474047

SCHEMBL1474047

O=C(NCCc1ccccn1)c1cc(-c2cccs2)on1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.64
LMNA P02545 6/20 0.64
HPGD P15428 4/20 0.64
NPC1 O15118 9/20 0.61
NPSR1 Q6W5P4 1/20 0.61
SMN1; SMN2 Q16637 8/20 0.61
KMT2A Q03164 6/20 0.61
MEN1 O00255 5/20 0.61
MAPT P10636 1/20 0.59
TSHR P16473 1/20 0.57
KDM4E B2RXH2 2/20 0.57
NFKB1 P19838 1/20 0.57
NFKB2 Q00653 1/20 0.57
RELA Q04206 1/20 0.57
MAPK1 P28482 1/20 0.57
TP53 P04637 3/20 0.56
ALDH1A1 P00352 4/20 0.55
PLEC Q15149 1/20 0.55
NTRK3 Q16288 1/20 0.55
CYP1A2 P05177 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
SCHEMBL17540221 0.86 RAB9A (0.59) RAB9ALMNAHPGDNPC1NPSR1
SCHEMBL17540208 0.86 RAB9A (0.57) RAB9ALMNAHPGDNPC1NPSR1
SCHEMBL1476766 0.84 RAB9A (0.80) RAB9ALMNAHPGDNPC1SMN1; SMN2
SCHEMBL4284349 0.84 RAB9A (0.78) RAB9ALMNAHPGDNPC1NPSR1
SCHEMBL15189982 0.83 NTRK3 (0.52) RAB9ALMNAHPGDNPC1NPSR1
SCHEMBL1179175 0.83 SMN1; SMN2 (0.69) RAB9ALMNAHPGDNPC1NPSR1
SCHEMBL1178332 0.83 RAB9A (0.71) RAB9ALMNAHPGDNPC1NPSR1
SCHEMBL9911645 0.82 RAB9A (0.77) RAB9ALMNAHPGDNPC1NPSR1
SCHEMBL1178252 0.81 RAB9A (0.71) RAB9ALMNAHPGDNPC1SMN1; SMN2
SCHEMBL29517825 0.81 SMN1; SMN2 (0.73) RAB9ALMNANPC1SMN1; SMN2KMT2A

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 2013/4885LMNA 2934/4885HPGD 732/4885

“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.