SCHEMBL21965732

SCHEMBL21965732

CC(C)Oc1ccc2cncn2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 1/20 0.38
TBXAS1 P24557 1/20 0.36
POLB P06746 1/20 0.34
FGFR1 P11362 1/20 0.34
KMT2A Q03164 2/20 0.33
WDR5 P61964 1/20 0.33
TP53 P04637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
BRD4 O60885 1/20 0.33
BRPF1 P55201 1/20 0.33
PARP10 Q53GL7 1/20 0.33
CYP1A2 P05177 1/20 0.32
MAPT P10636 1/20 0.32
QPCT Q16769 1/20 0.32
QPCTL Q9NXS2 1/20 0.32
CYP3A4 P08684 2/20 0.31
CYP3A5 P20815 2/20 0.31
BTK Q06187 1/20 0.31

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
SCHEMBL19781550 0.87 FDPS (0.40) ALDH1A3TBXAS1POLBWDR5TP53
SCHEMBL26328075 0.76 TBXAS1 (0.36) TBXAS1BRD4QPCTQPCTLESR1
SCHEMBL16589292 0.73 TBXAS1 (0.39) TBXAS1LMNABRD4IDO1TDO2
SCHEMBL23432572 0.70 TBXAS1 (0.37) TBXAS1ALDH1A1LMNABRD4CYP3A4
SCHEMBL31003223 0.70 TBXAS1 (0.40) TBXAS1ALDH1A1BRD4IDO1TDO2
SCHEMBL26826038 0.70 NR3C1 (0.37) TBXAS1BRD4IDO1ESR1
SCHEMBL2616777 0.70 TBXAS1 (0.41) TBXAS1POLBKMT2ATP53ALDH1A1
SCHEMBL20963444 0.69 TBXAS1 (0.49) TBXAS1LMNAIDO1ESR1
SCHEMBL17423771 0.69 LMNA (0.50) ALDH1A1LMNA
SCHEMBL29303795 0.68 EGLN1 (0.39) TBXAS1TP53BRD4

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-20200140456-A1 N/O-LINKED DEGRONS AND DEGRONIMERS FOR PROTEIN DEGRADATION C4 THERAPEUTICS, INC. (US) 2020-05-07 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-20200140456-A1 N/O-LINKED DEGRONS AND DEGRONIMERS FOR PROTEIN DEGRADATION CRBN, CBL, STUB1 ALDH1A3 4056/4885TBXAS1 2648/4885POLB 3920/4885

“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.