SCHEMBL21965754

SCHEMBL21965754

COc1c(Cl)cccc1NC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.43
RAF1 P04049 1/20 0.40
TAS1R3 Q7RTX0 2/20 0.38
TAS1R1 Q7RTX1 2/20 0.38
TAS1R2 Q8TE23 2/20 0.38
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HSD17B10 Q99714 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TYK2 P29597 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33

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
SCHEMBL8551899 0.79 NPC1 (0.47) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL936135 0.79 RAF1 (0.46) RAF1TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL9285104 0.79 RAF1 (0.43) RAF1TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL11062000 0.78 RAF1 (0.42) RAF1TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL11061853 0.78 RAF1 (0.42) RAF1TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL11201546 0.78 RAF1 (0.42) RAF1TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL12982749 0.77 RAF1 (0.42) RAF1TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL11411176 0.77 RAF1 (0.45) RAF1TAS1R3TAS1R1TAS1R2ALDH1A1
SCHEMBL8165575 0.76 NR4A2 (0.47) NR4A2ALDH1A1LMNAMEN1KMT2A
SCHEMBL3228979 0.76 TDP1 (0.46) NR4A2TAS1R3TAS1R1ALDH1A1LMNA

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 NR4A2 857/4885RAF1 890/4885TAS1R3 4400/4885

“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.