SCHEMBL19007350

SCHEMBL19007350

Cc1ccc(C)c2c1CCN2C

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.43
NOTUM Q6P988 1/20 0.34
ADRA2A P08913 1/20 0.31
CYP2D6 P10635 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
ADRA1D P25100 1/20 0.31
ADRA1A P35348 1/20 0.31
ADRA1B P35368 1/20 0.31
INMT O95050 1/20 0.30
ALOX12 P18054 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
SCHEMBL13184286 0.74 INMT (0.38) HTR2CADRA2ACYP2D6ADRA2BADRA2C
SCHEMBL24326976 0.70 HTR2C (0.38) HTR2CNOTUM
SCHEMBL256749 0.70 NOTUM (0.56) HTR2CNOTUM
SCHEMBL2625804 0.70 ALOX12 (0.50) HTR2CNOTUMADRA2ACYP2D6ADRA2B
SCHEMBL12950956 0.70 HTR2C (0.39) HTR2CNOTUMALOX12
SCHEMBL6975536 0.69 HAAO (0.38) NOTUM
SCHEMBL11784424 0.67 KMT2A (0.34) HTR2CADRA1DADRA1AADRA1BINMT
SCHEMBL256752 0.67 HTR2A (0.47) HTR2C
SCHEMBL19121514 0.67 INMT (0.41) HTR2CADRA1DADRA1AADRA1BINMT
SCHEMBL2625783 0.67 NOTUM (0.40) HTR2CNOTUMADRA2ACYP2D6ADRA2B

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-20170174689-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2017-06-22 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-20170174689-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL3 HTR2C 1865/4885NOTUM 4384/4885ADRA2A 3802/4885

“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.