SCHEMBL24364799

SCHEMBL24364799

CN(Cc1ccc2cc(C(C)(C)C)ccc2c1)c1ccc2c(c1)NCN2

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
SLC6A2 P23975 3/20 0.32
SLC6A4 P31645 3/20 0.32
SLC6A3 Q01959 3/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
ADRA1D P25100 1/20 0.32
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
ADRA1A P35348 1/20 0.32
ADRA1B P35368 1/20 0.32
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
DHFR P00374 1/20 0.31
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 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
SCHEMBL10165778 0.72 ALDH1A1 (0.40) CYP1A2CYP2C19ADRA2AADRA2BADRA2C
SCHEMBL19798873 0.65 TERT (0.47) CYP1A2CYP2C19
SCHEMBL13408602 0.63 EPHX2 (0.44) CYP1A2
SCHEMBL348347 0.63 ALDH1A1 (0.52) CYP1A2CYP2C19
SCHEMBL30010382 0.63 ALDH1A1 (0.52) CYP1A2CYP2C19
SCHEMBL15829267 0.63 KMT2A (0.44) CYP1A2CYP2C19ADRA2AADRA2BADRA2C
SCHEMBL5074296 0.63 ALDH1A1 (0.40) CYP1A2CYP2C19
SCHEMBL25780901 0.62 ESR1 (0.41) ADRA1DADRA1AADRA1B
SCHEMBL28105147 0.61 ALDH1A1 (0.50) CYP1A2CYP2C19
SCHEMBL12772098 0.61 NR1H2 (0.48) NR1H2NR1H3DHFR

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-20220127256-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2022-04-28 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-20220127256-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CYP1A2 50/4885CYP2C19 20/4885SLC6A2 885/4885

“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.