SCHEMBL4523847

SCHEMBL4523847

COc1ccccc1CC1CCN(Cc2c(Cl)cccc2Cl)C1=O

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
CYP2D6 P10635 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
USP2 O75604 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CMA1 P23946 1/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
ROCK2 O75116 1/20 0.41
KDM4E B2RXH2 1/20 0.41
OPRK1 P41145 2/20 0.40

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
SCHEMBL14177629 0.86 OPRK1 (0.50) CYP2D6MEN1KMT2AUSP2HSD17B10
SCHEMBL4525501 0.85 P2RX7 (0.45) MEN1KMT2AROCK2KDM4E
SCHEMBL4513457 0.81 TNKS (0.43) LMNAMEN1KMT2AKDM4E
SCHEMBL8320454 0.80 USP2 (0.47) LMNACYP2D6MEN1KMT2AUSP2
SCHEMBL6993832 0.78 LMNA (0.48) LMNACYP2D6MEN1KMT2AUSP2
SCHEMBL4505471 0.78 P2RX7 (0.49) MEN1KMT2AACHE
SCHEMBL4501886 0.78 TNKS (0.46) LMNAMEN1KMT2AKDM4E
SCHEMBL14177606 0.77 KCNH2 (0.53) CYP2D6OPRK1
SCHEMBL4509814 0.75 SIGMAR1 (0.44) LMNAMEN1KMT2A
SCHEMBL14177625 0.75 ALDH1A1 (0.50) CYP2D6KMT2ACMA1ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 EP disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 EP 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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes HSD11B1, HSD17B1, HSD11B2 LMNA 2846/4885CYP2D6 469/4885MEN1 1254/4885

“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.