SCHEMBL4281887

SCHEMBL4281887

COc1cc(O)ccc1-c1nnc(C)o1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GUSB P08236 17/20 0.60
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
BRD4 O60885 1/20 0.47
ESR1 P03372 1/20 0.46
ESR2 Q92731 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
SCHEMBL12918690 0.84 GUSB (0.49) GUSBALDH1A1LMNABRD4
SCHEMBL4856880 0.81 GUSB (0.49) GUSBALDH1A1LMNABRD4
SCHEMBL16442405 0.81 IMPDH2 (0.49) GUSBALDH1A1LMNABRD4
SCHEMBL430455 0.81 ALDH1A1 (0.47) GUSBALDH1A1LMNABRD4
SCHEMBL430069 0.78 ALDH1A1 (0.44) GUSBALDH1A1LMNABRD4
SCHEMBL1187141 0.78 ESR1 (0.47) GUSBESR1ESR2
SCHEMBL13393606 0.77 BRD4 (0.63) ALDH1A1LMNABRD4
SCHEMBL9623648 0.75 MAOB (0.67) GUSBALDH1A1ESR1ESR2
SCHEMBL4287576 0.74 GPR84 (0.40) GUSBBRD4ESR1ESR2
SCHEMBL4847997 0.74 CSF1R (0.43) GUSBALDH1A1LMNABRD4

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 6 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-20090227560-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-10 US disclosed
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
US-20090156612-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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 GUSB 1077/4885ALDH1A1 388/4885LMNA 1785/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT GUSB 1077/4885ALDH1A1 388/4885LMNA 1785/4885

“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.