SCHEMBL20906869

SCHEMBL20906869

COc1cc(CNCC(=O)N(CC(=O)N(CCCCN)CC(=O)N(C)CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(N)=O)Cc2ccccc2)[C@@H](C)c2ccccc2)Cc2ccc3c(c2)OCO3)[C@@H](C)c2ccccc2)CC(c2ccccc2)c2ccccc2)CC(c2ccccc2)c2ccccc2)ccc1C=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 2/20 0.49
▸ VIM P08670 1/20 0.40
▸ MAPT P10636 3/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HTR2A P28223 3/20 0.34
▸ HTR2C P28335 3/20 0.34
▸ HTR2B P41595 3/20 0.34
▸ ADRB1 P08588 1/20 0.34
▸ HTR1A P08908 1/20 0.34
▸ ADRA2A P08913 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ ADRA2B P18089 1/20 0.34
▸ ADRA2C P18825 1/20 0.34
▸ DRD1 P21728 1/20 0.34
▸ DRD4 P21917 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ ADRA1D P25100 1/20 0.34
▸ HTR1D P28221 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ HTR7 P34969 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
SCHEMBL20906849 0.95 CREBBP (0.51) CREBBPVIMMAPTSMN1; SMN2HTR2A
SCHEMBL20906815 0.92 CREBBP (0.55) CREBBPVIMMAPTHTR2AHTR2C
SCHEMBL20906872 0.87 CREBBP (0.42) CREBBPMAPTSMN1; SMN2HTR2AHTR2C
SCHEMBL20906812 0.82 CREBBP (0.46) CREBBPVIMMAPTSMN1; SMN2HTR2A
SCHEMBL20906813 0.77 CREBBP (0.47) CREBBPVIMMAPTSMN1; SMN2HTR2A
SCHEMBL13671131 0.77 CREBBP (0.51) CREBBPVIMMAPTSMN1; SMN2ALDH1A1
SCHEMBL12754797 0.76 CREBBP (0.50) CREBBPVIMMAPTSMN1; SMN2ALDH1A1
SCHEMBL17424484 0.75 CREBBP (0.49) CREBBPVIMMAPTSMN1; SMN2ALDH1A1
SCHEMBL17424488 0.74 CREBBP (0.47) CREBBPVIMMAPTSMN1; SMN2OPRM1
SCHEMBL21376771 0.72 MC4R (0.54) CREBBPMC4RMC3RMC5RMC1R

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-10458995-B2 Combinatorial synthesis and biomarker development TEN30 BIOSCIENCES, INC. 2019-10-29 — — US disclosed
US-20190113521-A1 COMBINATORIAL SYNTHESIS AND BIOMARKER DEVELOPMENT TEN30 BIOSCIENCES, INC. 2019-04-18 — — 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 (2 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-20190113521-A1 COMBINATORIAL SYNTHESIS AND BIOMARKER DEVELOPMENT APP, PSEN2, PSEN1 CREBBP 167/4885VIM 2118/4885MAPT 8/4885
US-10458995-B2 Combinatorial synthesis and biomarker development APP, PSEN2, PSEN1 CREBBP 165/4885VIM 2070/4885MAPT 9/4885

“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.

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