SCHEMBL12417638

SCHEMBL12417638

CCOCn1cc(C)c(O)c(C(=O)NC)c1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
KDM4E B2RXH2 5/20 0.32
ALDH1A1 P00352 4/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
BRD4 O60885 1/20 0.31
PLK1 P53350 1/20 0.31
NPC1 O15118 1/20 0.31
ALOX15 P16050 1/20 0.31
HTT P42858 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
USP2 O75604 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MMP14 P50281 1/20 0.30

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
SCHEMBL12417623 0.84 TSHR (0.43) TSHRKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL12417609 0.77 PLK1 (0.35) TSHRKDM4EALDH1A1L3MBTL1BRD4
SCHEMBL12417617 0.76 BRD4 (0.44) TSHRKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL12417636 0.74 TSHR (0.42) TSHRKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL12417658 0.72 TSHR (0.41) TSHRKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL12417645 0.72 TSHR (0.41) TSHRKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL12417615 0.70 RAB9A (0.46) TSHRKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL12417637 0.70 TSHR (0.37) TSHRKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL14624927 0.66 CA12 (0.34) ALDH1A1HPGDL3MBTL1NPC1MEN1
SCHEMBL13498529 0.65 HDAC8 (0.39) TSHRKDM4EALDH1A1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304437-B2 Carboxamide compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-06 US disclosed
US-20110172276-A1 CARBOXAMIDE COMPOUND AND USE OF THE SAME ARIMORI SADAYUKI 2011-07-14 US disclosed
US-7943614-B2 Carboxamide compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-17 US disclosed
US-7943638-B2 Carboxamide compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-17 US disclosed
US-7935716-B2 Carboxamide compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-03 US disclosed
US-20090111852-A1 Carboxamide Compound and Use of the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-30 US disclosed
US-20090111815-A1 Carboxamide Compound and Use of the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-04-30 US disclosed
US-20090076063-A1 Carboxamide compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-19 US 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 (4 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-20090111852-A1 Carboxamide Compound and Use of the Same CBR3, H1-3, H1-0 TSHR 3874/4885KDM4E 1050/4885ALDH1A1 2339/4885
US-20090076063-A1 Carboxamide compound and use of the same CBR3, SIRT2, SIRT1 TSHR 2270/4885KDM4E 988/4885ALDH1A1 3016/4885
US-20110172276-A1 CARBOXAMIDE COMPOUND AND USE OF THE SAME CBR3, SIRT2, SIRT1 TSHR 2270/4885KDM4E 988/4885ALDH1A1 3016/4885
US-20090111815-A1 Carboxamide Compound and Use of the Same NAA50, SIRT1, NQO2 TSHR 4219/4885KDM4E 742/4885ALDH1A1 2362/4885

“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.