SCHEMBL14035628

SCHEMBL14035628

CCn1c(-c2ccccc2)ccc1-c1ccc(OC)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK2 Q13002 4/20 0.59
GRIK1 P39086 2/20 0.59
KDM4E B2RXH2 5/20 0.49
ALDH1A1 P00352 5/20 0.49
HPGD P15428 4/20 0.49
MAPT P10636 3/20 0.49
KMT2A Q03164 3/20 0.49
BACE1 P56817 3/20 0.49
LMNA P02545 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
MEN1 O00255 2/20 0.49
GAA P10253 2/20 0.49
USP2 O75604 1/20 0.49
POLB P06746 1/20 0.49
ALOX15 P16050 1/20 0.49
ALOX12 P18054 1/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CYP11B1 P15538 1/20 0.47

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
SCHEMBL17694697 0.81 KDM4E (0.51) GRIK2GRIK1KDM4EALDH1A1HPGD
SCHEMBL8446905 0.80 ALDH1A1 (0.49) GRIK2GRIK1KDM4EALDH1A1HPGD
SCHEMBL4483861 0.80 BACE1 (0.61) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL8446966 0.78 ALDH1A1 (0.52) GRIK2GRIK1KDM4EALDH1A1HPGD
SCHEMBL4472383 0.78 KDM4E (0.61) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL15591268 0.76 KDM4E (0.50) GRIK2GRIK1KDM4EALDH1A1HPGD
SCHEMBL9152375 0.76 CA4 (0.68) KDM4EALDH1A1BACE1LMNANPSR1
SCHEMBL17283658 0.76 CA4 (0.68) KDM4EALDH1A1BACE1LMNANPSR1
SCHEMBL291776 0.76 CA4 (0.68) KDM4EALDH1A1BACE1LMNANPSR1
Biphenyl SCHEMBL11784329 0.76 CA4 (0.68) KDM4EALDH1A1BACE1LMNANPSR1

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-20080287424-A1 AZOLYLACYLGUANIDINES AS beta-SECRETASE INHIBITORS WYETH (US) 2008-11-20 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-20080287424-A1 AZOLYLACYLGUANIDINES AS beta-SECRETASE INHIBITORS BACE1, BACE2, APP GRIK2 596/4885GRIK1 643/4885KDM4E 1462/4885

“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.