SCHEMBL4285804

SCHEMBL4285804

CCOC(=O)c1ncn([C@H]2CCCC[C@@H]2NC(=O)OC2CCC2)c1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP19A1 P11511 1/20 0.38
MAPT P10636 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALDH1A1 P00352 3/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
EED O75530 2/20 0.37
LMNA P02545 1/20 0.37
RAB9A P51151 1/20 0.37
ELANE P08246 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
FAAH O00519 4/20 0.36
MGLL Q99685 2/20 0.36

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
SCHEMBL4296461 0.92 CYP19A1 (0.41) MEN1GAATSHRKMT2ACYP19A1
SCHEMBL13705066 0.92 CYP19A1 (0.41) MEN1GAATSHRKMT2ACYP19A1
SCHEMBL4296458 0.92 CYP19A1 (0.41) MEN1GAATSHRKMT2ACYP19A1
SCHEMBL4285560 0.92 CYP19A1 (0.41) MEN1GAATSHRKMT2ACYP19A1
SCHEMBL4282224 0.92 CYP19A1 (0.41) MEN1GAATSHRKMT2ACYP19A1
SCHEMBL4283612 0.92 CYP19A1 (0.41) MEN1GAATSHRKMT2ACYP19A1
SCHEMBL4296455 0.92 CYP19A1 (0.41) MEN1GAATSHRKMT2ACYP19A1
SCHEMBL4284004 0.88 FAAH (0.40) TSHRALDH1A1LMNARAB9AFAAH
SCHEMBL4289748 0.87 EPHX1 (0.44) GAATSHRCYP19A1ALDH1A1EED
SCHEMBL4292552 0.87 CKS1B (0.41) MEN1GAATSHRKMT2ACYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227560-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-10 US disclosed
US-20090156612-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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 (2 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-20090156612-A1 Substituted imidazole compound and use thereof REN, ACE, AGT MEN1 1254/4885GAA 1381/4885TSHR 3226/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT MEN1 1254/4885GAA 1381/4885TSHR 3226/4885

“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.