SCHEMBL18975402

SCHEMBL18975402

COc1cc2c(cc1C(C)=O)c1c3c(ccc1n2CC[C@H]1CCCN1C)C(=O)CC3

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.74
ADRA2A P08913 1/20 0.37
ACKR3 P25106 8/20 0.37
CHRM3 P20309 1/20 0.35
UHRF1 Q96T88 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MCHR1 Q99705 3/20 0.35
PLK1 P53350 1/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
NPBWR1 P48145 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
TLR9 Q9NR96 1/20 0.34
TLR8 Q9NR97 1/20 0.34
TLR7 Q9NYK1 1/20 0.34

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
SCHEMBL18969209 1.00 TP53 (0.74) TP53ADRA2AACKR3CHRM3UHRF1
SCHEMBL12608716 0.90 TP53 (0.76) TP53ADRA2ACHRM3PLK1
SCHEMBL13418930 0.90 TP53 (0.76) TP53ADRA2ACHRM3PLK1
SCHEMBL13637166 0.85 TP53 (1.00) TP53ADRA2APLK1
SCHEMBL13637360 0.85 TP53 (1.00) TP53ADRA2APLK1
SCHEMBL13418901 0.85 TP53 (1.00) TP53ADRA2APLK1
SCHEMBL12608662 0.84 TP53 (0.48) TP53ADRA2AACKR3UHRF1MCHR1
SCHEMBL18500535 0.84 TP53 (0.48) TP53ADRA2AACKR3UHRF1MCHR1
SCHEMBL16131505 0.84 TP53 (0.49) TP53KDM4E
SCHEMBL21441042 0.83 TP53 (0.60) TP53ACKR3TLR9TLR8TLR7

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-20170165229-A1 CARBAZOLE COMPOUNDS AND THERAPEUTIC USES OF THE COMPOUNDS INCURON, INC. 2017-06-15 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-20170165229-A1 CARBAZOLE COMPOUNDS AND THERAPEUTIC USES OF THE COMPOUNDS MALT1, PAICS, BCL9 TP53 28/4885ADRA2A 3619/4885ACKR3 726/4885

“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.