SCHEMBL10172755

SCHEMBL10172755

Cc1cc(Br)cc(Cn2cncn2)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 12/20 0.49
UGT1A4 P22310 1/20 0.48
PDE4D Q08499 1/20 0.48
HDAC1 Q13547 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
ACHE P22303 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
SCHEMBL14991056 0.77 CYP19A1 (0.51) CYP19A1UGT1A4PDE4DHDAC1HDAC6
SCHEMBL7081887 0.76 CYP19A1 (0.64) CYP19A1UGT1A4PDE4DHDAC1HDAC6
SCHEMBL3115446 0.75 CYP19A1 (0.65) CYP19A1UGT1A4PDE4DHDAC1HDAC6
SCHEMBL305624 0.75 CYP19A1 (0.65) CYP19A1HDAC1HDAC6CYP11B1CYP11B2
SCHEMBL10172609 0.75 CYP19A1 (0.82) CYP19A1UGT1A4PDE4D
SCHEMBL3318872 0.74 CYP19A1 (0.67) CYP19A1UGT1A4PDE4DHDAC1HDAC6
SCHEMBL306232 0.74 CYP19A1 (0.67) CYP19A1UGT1A4PDE4DHDAC1HDAC6
SCHEMBL12908863 0.73 CYP19A1 (0.85) CYP19A1UGT1A4PDE4D
SCHEMBL28786049 0.73 CYP11B1 (0.50) CYP19A1UGT1A4PDE4DCYP11B1CYP11B2
Hydrochloric Acid SCHEMBL11228283 0.73 CYP19A1 (0.65) CYP19A1UGT1A4PDE4DHDAC1HDAC6

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 605/4885UGT1A4 2132/4885PDE4D 3657/4885

“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.