SCHEMBL4281250

SCHEMBL4281250

Cc1cc(C)n(CC[C@@H]2CN(C(=O)O)CCN2C(=O)O)n1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
LMNA P02545 2/20 0.43
KMT2A Q03164 1/20 0.43
POLB P06746 2/20 0.43
APAF1 O14727 1/20 0.43
GFER P55789 1/20 0.41
PKM P14618 2/20 0.40
GLS O94925 1/20 0.39
CXCR3 P49682 1/20 0.39
KCNH2 Q12809 1/20 0.39
ALDH1A1 P00352 2/20 0.38

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
SCHEMBL4291155 0.83 SMN1; SMN2 (0.38) KDM4ELMNAPOLBALDH1A1
SCHEMBL4288567 0.83 FAAH (0.34) KMT2APOLB
SCHEMBL4284630 0.77 CNR2 (0.35) KDM4EKMT2A
Hydrochloric Acid SCHEMBL4281770 0.76 KDM4E (0.44) KDM4ELMNAKMT2APOLBAPAF1
SCHEMBL4286066 0.74 RAB9A (0.35) KDM4ELMNAPOLBALDH1A1
SCHEMBL4289775 0.74 HPGD (0.31) KMT2APOLBPKMALDH1A1
SCHEMBL4283406 0.74 GRN (0.38) KDM4ELMNAKMT2APOLBALDH1A1
SCHEMBL4291731 0.74 SMN1; SMN2 (0.38) KDM4ELMNAPOLBALDH1A1
SCHEMBL4285493 0.73 LMNA (0.36) LMNAKMT2AALDH1A1
SCHEMBL18426382 0.72 LMNA (0.48) KDM4ELMNAPOLBAPAF1GFER

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 KDM4E 760/4885LMNA 1785/4885KMT2A 1049/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT KDM4E 760/4885LMNA 1785/4885KMT2A 1049/4885

“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.