SCHEMBL4108665

SCHEMBL4108665

Cc1ccccc1CCc1cccc(CN2CCNCC2)c1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
SIGMAR1 Q99720 2/20 0.54
BRD4 O60885 1/20 0.46
MLNR O43193 1/20 0.45
TNKS O95271 1/20 0.45
KMT2A Q03164 2/20 0.43
CHRM3 P20309 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP2A13 Q16696 1/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A2 P23975 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
CXCR4 P61073 2/20 0.42
ACHE P22303 1/20 0.41
CHEK1 O14757 1/20 0.41

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
SCHEMBL29168432 0.84 LMNA (0.71) LMNASIGMAR1KMT2ACHRM3KDM4E
SCHEMBL27782053 0.80 ALDH1A1 (0.56) LMNAKMT2AKDM4EMEN1ALDH1A1
SCHEMBL593284 0.79 LMNA (0.96) LMNASIGMAR1KMT2AKDM4EMEN1
SCHEMBL1259602 0.79 SIGMAR1 (0.71) SIGMAR1BRD4KMT2AMEN1CXCR4
SCHEMBL21961925 0.79 SIGMAR1 (0.71) SIGMAR1BRD4KMT2AMEN1CXCR4
Hydrochloric Acid SCHEMBL2924720 0.78 LMNA (1.00) LMNASIGMAR1KMT2AKDM4EMEN1
Hydrochloric Acid SCHEMBL7417639 0.78 LMNA (1.00) LMNASIGMAR1KMT2AKDM4EMEN1
Bromide SCHEMBL1259195 0.77 SIGMAR1 (0.69) SIGMAR1BRD4KMT2AMEN1ALDH1A1
SCHEMBL593734 0.76 SIGMAR1 (0.62) LMNASIGMAR1KMT2ACHRM3KDM4E
SCHEMBL12320535 0.76 SIGMAR1 (0.62) LMNASIGMAR1BRD4KMT2ACHRM3

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-20090062294-A1 HETEROARYL-SUBSTITUTED UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2009-03-05 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-20090062294-A1 HETEROARYL-SUBSTITUTED UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, GPR119 LMNA 2277/4885SIGMAR1 1261/4885BRD4 560/4885

“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.