SCHEMBL3058753

SCHEMBL3058753

CCC1Cc2cc(O)c(OC)cc2CN1Cc1cccc(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHCR7 Q9UBM7 1/20 0.53
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
ALDH1A1 P00352 1/20 0.43
CMA1 P23946 1/20 0.41
DRD2 P14416 7/20 0.41
DRD3 P35462 3/20 0.41
DRD4 P21917 2/20 0.41
TMEM97 Q5BJF2 1/20 0.41
DRD1 P21728 4/20 0.41
ACHE P22303 4/20 0.40
SIGMAR1 Q99720 1/20 0.40
DRD5 P21918 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL3050133 0.87 DHCR7 (0.55) DHCR7CA2CA9ALDH1A1CMA1
SCHEMBL3051401 0.85 CHRNA7 (0.49) CA2CA9ALDH1A1DRD2SIGMAR1
SCHEMBL3056180 0.82 CA9 (0.72) CA2CA9DRD2DRD3DRD1
SCHEMBL3052036 0.76 DHCR7 (0.80) DHCR7CA2CA9ALDH1A1DRD2
SCHEMBL3054594 0.75 CA2 (0.48) DHCR7CA2CA9DRD2DRD3
SCHEMBL3054533 0.74 DHCR7 (0.70) DHCR7CA2CA9ALDH1A1DRD2
SCHEMBL3055295 0.74 DHCR7 (0.58) DHCR7CA2CA9ALDH1A1CMA1
SCHEMBL3057653 0.73 DRD2 (0.61) DHCR7ALDH1A1DRD2DRD3DRD1
SCHEMBL5025188 0.72 BCHE (0.50) CA2CA9SIGMAR1
SCHEMBL18098775 0.72 CA2 (0.70) DHCR7CA2CA9ALDH1A1CMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394825-B2 Compound STERIX LIMITED (GB) 2013-03-12 US disclosed
US-20100222299-A1 COMPOUND STERIX LIMITED (GB) 2010-09-02 US disclosed
EP-2155192-A2 TETRAHYDROISOQUINOLINES AS TUMOUR GROWTH INHIBITORS Sterix Limited (GB) 2010-02-24 EP disclosed
WO-2008117061-A2 TETRAHYDROISOQUINOLINES AS TUMOUR GROWTH INHIBITORS STERIX LIMITED (GB) 2008-10-02 WO 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-20100222299-A1 COMPOUND MKI67, VHL, MYC DHCR7 421/4885CA2 1077/4885CA9 1002/4885

“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.