SCHEMBL1708448

SCHEMBL1708448

COC(=O)c1cccc(Nc2ccc(Cl)cc2NC(=O)[C@H]2CCCO2)c1C

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
ALDH1A1 P00352 4/20 0.59
HSD17B10 Q99714 4/20 0.56
TSHR P16473 1/20 0.56
HPGD P15428 3/20 0.53
KMT2A Q03164 1/20 0.48
RAB9A P51151 3/20 0.48
LMNA P02545 2/20 0.48
NPC1 O15118 3/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL1707707 0.89 SMN1; SMN2 (0.75) KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR
SCHEMBL1708514 0.89 SMN1; SMN2 (0.62) KDM4ESMN1; SMN2ALDH1A1HSD17B10HPGD
SCHEMBL1707835 0.86 SMN1; SMN2 (0.59) KDM4ESMN1; SMN2ALDH1A1HSD17B10HPGD
SCHEMBL1708521 0.85 SMN1; SMN2 (0.58) KDM4ESMN1; SMN2ALDH1A1HSD17B10HPGD
SCHEMBL15120766 0.74 HSD17B10 (0.68) KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR
SCHEMBL1307213 0.73 HSD17B10 (1.00) KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR
SCHEMBL14963919 0.72 HSD17B10 (0.73) KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR
SCHEMBL14963903 0.71 ALDH1A1 (0.73) KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR
SCHEMBL1707863 0.69 SMN1; SMN2 (0.53) KDM4ESMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL14963908 0.69 LMNA (0.64) KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR

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-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-07-05 US disclosed
EP-2440541-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2012-04-18 EP disclosed
WO-2010143733-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-16 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-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF GPR119, INSR, GLP1R KDM4E 3896/4885SMN1; SMN2 4287/4885ALDH1A1 3930/4885

“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.