SCHEMBL5529415

SCHEMBL5529415

CN(C)C(c1ccccc1)(c1cnccn1)C(N)(Cl)CCl

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 5/20 0.43
CHRM2 P08172 1/20 0.35
BLM P54132 1/20 0.31
CYP2D6 P10635 1/20 0.31
KCNA5 P22460 1/20 0.31
KCNN4 O15554 1/20 0.30

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
SCHEMBL5529411 0.68 CYP3A4 (0.36) CHRM2CYP2D6KCNA5KCNN4
SCHEMBL9118898 0.67 CYP19A1 (0.39) CYP19A1CYP2D6KCNA5
SCHEMBL13505959 0.66 CYP19A1 (0.46) CYP19A1CHRM2KCNA5
SCHEMBL28680178 0.65 CYP19A1 (0.49) CYP19A1KCNA5
SCHEMBL11685815 0.64 CYP19A1 (0.71) CYP19A1KCNA5
SCHEMBL11264781 0.63 CYP19A1 (0.44) CYP19A1KCNA5
SCHEMBL11628919 0.62 CYP19A1 (0.43) CYP19A1KCNA5
SCHEMBL9658903 0.61 CYP19A1 (0.49) CYP19A1KCNA5
SCHEMBL9661803 0.61 CYP19A1 (0.49) CYP19A1KCNA5
SCHEMBL8938124 0.60 CYP19A1 (0.44) CYP19A1KCNA5

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-20070225287-A1 Substituted Arylpyrazines YOON TAEYOUNG 2007-09-27 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-20070225287-A1 Substituted Arylpyrazines CRHR1, CRHR2, CRH CYP19A1 2020/4885CHRM2 461/4885BLM 4602/4885

“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.