SCHEMBL5550873

SCHEMBL5550873

NC(=O)Nc1oc(-c2ccccc2)nc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 2/20 0.55
KDM4E B2RXH2 4/20 0.50
HSD17B10 Q99714 3/20 0.50
PPARG P37231 1/20 0.50
NCOA2 Q15596 1/20 0.50
SLC9A1 P19634 1/20 0.46
GAA P10253 3/20 0.45
ALDH1A1 P00352 4/20 0.45
HPGD P15428 2/20 0.45
TARBP2 Q15633 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
CYP1A2 P05177 1/20 0.42
KMT2A Q03164 1/20 0.42
RAB9A P51151 2/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
DHODH Q02127 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41

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
SCHEMBL6015244 0.81 KDM4E (0.44) IKBKBKDM4EHSD17B10PPARGNCOA2
SCHEMBL6526404 0.78 KDM4E (0.45) IKBKBKDM4EHSD17B10PPARGNCOA2
SCHEMBL27790569 0.76 IKBKB (0.78) IKBKBKDM4EHSD17B10PPARGNCOA2
SCHEMBL1564197 0.75 CHEK1 (0.56)
SCHEMBL4487202 0.74 IKBKB (0.56) IKBKBKDM4EHSD17B10PPARGNCOA2
SCHEMBL1384983 0.73 IKBKB (0.67) IKBKBKDM4EHSD17B10PPARGNCOA2
SCHEMBL2791619 0.72 IKBKB (0.54) IKBKBKDM4EHSD17B10PPARGNCOA2
SCHEMBL2179708 0.72 TARBP2 (0.64) IKBKBKDM4EHSD17B10PPARGNCOA2
SCHEMBL2794712 0.72 IKBKB (0.54) IKBKBKDM4EHSD17B10PPARGNCOA2
SCHEMBL596762 0.72 TARBP2 (0.52) IKBKBKDM4EHSD17B10PPARGNCOA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070010556-A1 Thiophene derivatives as chk 1 inhibitors ASTRAZENECA AB (SE) 2007-01-11 US disclosed
EP-1732920-A2 THIOPHENE DERIVATIVES AS CHK 1 INHIBITORS AstraZeneca AB (SE) 2006-12-20 EP disclosed
WO-2005066163-A2 THIOPHENE DERIVATIVES AS CHK 1 INIHIBITORS ASTRAZENECA AB (SE) 2005-07-21 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-20070010556-A1 Thiophene derivatives as chk 1 inhibitors CHEK1, CHKA, CHEK2 IKBKB 581/4885KDM4E 713/4885HSD17B10 2029/4885

“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.