SCHEMBL4295550

SCHEMBL4295550

COC(=O)Cc1ccc(OCC[C@@H]2CN(C(=O)O)CCN2)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.43
LTA4H P09960 4/20 0.40
KDM4E B2RXH2 1/20 0.39
LIPE Q05469 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
RAB9A P51151 3/20 0.39
ALDH1A1 P00352 2/20 0.39
NPC1 O15118 2/20 0.38
LMNA P02545 1/20 0.38
MMP9 P14780 1/20 0.38
PARP1 P09874 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 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
Hydrochloric Acid SCHEMBL4283402 0.99 KDM1A (0.42) KDM1ALTA4HKDM4ELIPESMN1; SMN2
SCHEMBL4301626 0.90 ITGB3 (0.41) LTA4HKDM4ESMN1; SMN2ALDH1A1LMNA
SCHEMBL4972244 0.89 LTA4H (0.47) KDM1ALTA4HKDM4ELIPESMN1; SMN2
Hydrochloric Acid SCHEMBL4289679 0.89 ITGB3 (0.41) LTA4HKDM4ESMN1; SMN2ALDH1A1LMNA
Hydrochloric Acid SCHEMBL4287144 0.85 HPGD (0.47) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL4282373 0.84 L3MBTL1 (0.47) SMN1; SMN2ALDH1A1PARP1
SCHEMBL4751897 0.84 L3MBTL1 (0.47) SMN1; SMN2ALDH1A1PARP1
SCHEMBL4293311 0.84 HRH3 (0.43) LTA4HPARP1
Hydrochloric Acid SCHEMBL4285610 0.83 L3MBTL1 (0.46) SMN1; SMN2ALDH1A1PARP1
Hydrochloric Acid SCHEMBL4286145 0.83 HRH3 (0.42) LTA4HPARP1

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 1 patent. 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

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-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT KDM1A 661/4885LTA4H 1197/4885KDM4E 760/4885

“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.