SCHEMBL31407903

SCHEMBL31407903

CCCCOC(=O)N1CC=C(c2cccc3[nH]c(=O)n(C)c23)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK4 Q16654 1/20 0.41
MAPT P10636 5/20 0.39
JAK1 P23458 8/20 0.37
JAK2 O60674 6/20 0.37
HSD17B10 Q99714 3/20 0.37
ALDH1A1 P00352 3/20 0.37
TSHR P16473 2/20 0.37
KDM4E B2RXH2 2/20 0.37
USP2 O75604 1/20 0.37
ALOX15 P16050 1/20 0.37
HTT P42858 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HRH2 P25021 1/20 0.36
HRH1 P35367 1/20 0.36
PDE10A Q9Y233 1/20 0.36

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
SCHEMBL25338940 0.82 PDK4 (0.60) PDK4JAK1
SCHEMBL21997875 0.75 CRBN (0.45) PDK4JAK1JAK2
SCHEMBL14144348 0.75 ALDH1A1 (0.54) MAPTALDH1A1TSHRKDM4EALOX15
SCHEMBL29650110 0.71 LMNA (0.47) MAPTALDH1A1TSHRKDM4EALOX15
SCHEMBL29948559 0.71 CNR1 (0.50) MAPTALDH1A1KDM4EHTTLMNA
SCHEMBL30659346 0.70 PTGDR2 (0.41) MAPTJAK1JAK2TSHRLMNA
SCHEMBL18129721 0.70 PRKACA (0.56) MAPT
SCHEMBL7648302 0.70 MAPT (0.53) PDK4MAPTJAK1HSD17B10ALDH1A1
SCHEMBL5460918 0.70 CYP1A2 (0.43) MAPTJAK1JAK2ALDH1A1KDM4E
SCHEMBL2453898 0.69 KMT2A (0.39) PDK4MAPTJAK1JAK2ALDH1A1

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-20250059164-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-02-20 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-20250059164-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 PDK4 1336/4885MAPT 2459/4885JAK1 165/4885

“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.