SCHEMBL1476629

SCHEMBL1476629

Cc1ccc(N2CCN(CCNC(=O)c3cc(-c4ccco4)on3)CC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
SMN1; SMN2 Q16637 4/20 0.59
HPGD P15428 3/20 0.59
NPC1 O15118 3/20 0.59
RAB9A P51151 3/20 0.59
LMNA P02545 3/20 0.59
TP53 P04637 1/20 0.59
GAA P10253 1/20 0.59
HTR1A P08908 2/20 0.56
KDM4E B2RXH2 1/20 0.55
HSD17B10 Q99714 1/20 0.55
HTT P42858 2/20 0.55
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
DRD2 P14416 1/20 0.52
DRD4 P21917 1/20 0.52
SCD5 Q86SK9 1/20 0.52

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
SCHEMBL1474960 0.91 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL1475081 0.90 SMN1; SMN2 (0.60) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL1476638 0.90 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL1475255 0.90 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL1475690 0.87 RAB9A (0.53) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL1477101 0.87 RAB9A (0.67) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL1474506 0.87 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL1477057 0.86 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL15190272 0.85 DRD2 (0.47) ALDH1A1LMNAHTR1AKMT2AMEN1
SCHEMBL1474195 0.85 DRD4 (0.58) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A

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 ALDH1A1 706/4885SMN1; SMN2 3980/4885HPGD 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.