SCHEMBL5230696

SCHEMBL5230696

CCOC(=O)c1c(-c2ccccc2)c2ccc(Cl)cc2c(=O)n1C

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
HPGD P15428 3/20 0.55
CYP1A2 P05177 3/20 0.55
CYP2C19 P33261 3/20 0.55
XBP1 P17861 1/20 0.55
CSF1R P07333 1/20 0.54
DPP4 P27487 5/20 0.52
MAPK8 P45983 4/20 0.50
TACR1 P25103 1/20 0.50
TSHR P16473 2/20 0.48
GABRA2 P47869 2/20 0.46
GABRB2 P47870 2/20 0.46
CYP2C9 P11712 2/20 0.46
MEN1 O00255 1/20 0.46
CYP2D6 P10635 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL6106131 0.88 TSHR (0.50) ALDH1A1HPGDCYP1A2CYP2C19XBP1
SCHEMBL1381652 0.87 TSHR (0.55) ALDH1A1HPGDMAPK8TACR1TSHR
SCHEMBL8785961 0.86 TSHR (0.55) ALDH1A1HPGDMAPK8TACR1TSHR
SCHEMBL5233063 0.84 TACR1 (0.46) ALDH1A1HPGDCYP1A2CYP2C19XBP1
SCHEMBL6109847 0.84 DPP4 (0.56) DPP4MAPK8TACR1
SCHEMBL5240987 0.84 GABRA2 (0.48) ALDH1A1HPGDCYP1A2CYP2C19XBP1
SCHEMBL5231074 0.83 MAPK8 (0.46) ALDH1A1HPGDCYP1A2CYP2C19XBP1
SCHEMBL5236865 0.82 ALDH1A1 (0.54) ALDH1A1HPGDCYP1A2CYP2C19TSHR
SCHEMBL5233680 0.82 TACR1 (0.55) ALDH1A1HPGDCYP1A2CYP2C19XBP1
SCHEMBL6109300 0.81 MAPT (0.48) ALDH1A1DPP4MAPK8TACR1GABRA2

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
EP-1355886-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2007-07-11 EP disclosed
US-7034039-B2 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-25 US disclosed
US-20040082607-A1 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-29 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 (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-20040082607-A1 Fused heterocyclic compounds DPP7, DPP4, METAP1 ALDH1A1 387/4885HPGD 1241/4885CYP1A2 752/4885

“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.