SCHEMBL10172571

SCHEMBL10172571

Cc1ccc(C#Cc2cccc(Cn3cncn3)c2)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 18/20 0.50
HDAC1 Q13547 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
STS P08842 2/20 0.43
UGT1A4 P22310 1/20 0.38
PDE4D Q08499 1/20 0.38

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
SCHEMBL307287 0.86 CYP19A1 (0.58) CYP19A1HDAC1HDAC6STS
SCHEMBL14647083 0.81 CYP19A1 (0.67) CYP19A1HDAC1HDAC6STS
SCHEMBL12268248 0.80 CYP19A1 (0.44) CYP19A1HDAC1HDAC6STS
SCHEMBL305324 0.79 CYP19A1 (0.73) CYP19A1STS
SCHEMBL10172779 0.77 CYP19A1 (0.50) CYP19A1HDAC1HDAC6STS
SCHEMBL307543 0.75 CYP19A1 (0.60) CYP19A1HDAC1HDAC6STSUGT1A4
SCHEMBL3456043 0.75 CYP19A1 (0.68) CYP19A1HDAC1HDAC6UGT1A4PDE4D
SCHEMBL3115446 0.73 CYP19A1 (0.65) CYP19A1HDAC1HDAC6STSUGT1A4
Hydrochloric Acid SCHEMBL11347612 0.72 CYP19A1 (0.67) CYP19A1HDAC1HDAC6STS
SCHEMBL10066953 0.70 CYP19A1 (0.65) CYP19A1HDAC1HDAC6STSUGT1A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093279-B2 Compound STERIX LIMITED (GB) 2012-01-10 US disclosed
US-20100173963-A1 COMPOUND STERIX LIMITED (GB) 2010-07-08 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-20100173963-A1 COMPOUND CBR3, CBR1, OXSR1 CYP19A1 605/4885HDAC1 1848/4885HDAC6 2791/4885

“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.