SCHEMBL3240481

SCHEMBL3240481

COC(=O)C1Cc2ccccc2C(CCCP(=O)(O)O)N1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 4/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
OPRM1 P35372 3/20 0.35
OPRK1 P41145 1/20 0.35
CCKBR P32239 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL5740073 0.82 PDE5A (0.37) PDE5AMEN1KMT2AKDM4ETSHR
SCHEMBL7995094 0.71 ALDH1A1 (0.36) MEN1KMT2ATSHRALDH1A1
SCHEMBL5059550 0.70 OPRM1 (0.52) KDM4EOPRM1OPRK1ALDH1A1
SCHEMBL6831393 0.70 HTR2A (0.36) KDM4EOPRM1OPRK1ALDH1A1
SCHEMBL28209006 0.69 PDE5A (0.41) PDE5AMEN1KMT2AKDM4ETSHR
SCHEMBL28296124 0.68 GAA (0.35) MEN1KMT2ATSHROPRM1OPRK1
SCHEMBL24177405 0.67 MEN1 (0.45) PDE5AMEN1KMT2AKDM4ETSHR
SCHEMBL4881527 0.67 PTPRA (0.36) MEN1KMT2AKDM4ETSHRHTT
SCHEMBL3249767 0.67 CYP2D6 (0.41) MEN1KMT2AKDM4ETSHROPRM1
SCHEMBL29365938 0.67 MEN1 (0.45) PDE5AMEN1KMT2AKDM4ETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1227803-B1 COMPOUNDS FOR INHIBITING IAPP-ASSOCIATED AMYLOID DEPOSITS BELLUS HEALTH INTERNATIONAL LTD (CH) 2010-05-05 EP claimed
US-6562836-B1 Islet amyloid polypeptide (IAPP) is known to be capable of forming fibrils which are deposited in the pancreas of patients wtih type II diabetes QUEEN'S UNIVERSITY OF KINGSTON (CA) 2003-05-13 US claimed
US-20070078082-A1 Methods and compositions to treat glycosaminoglycan-associated molecular interactions NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2007-04-05 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-20070078082-A1 Methods and compositions to treat glycosaminoglycan-associated molecular interactions HPSE, CD44, CSGALNACT1 PDE5A 2539/4885MEN1 3711/4885KMT2A 4400/4885

“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.