SCHEMBL23768142

SCHEMBL23768142

CCCCCC(C)(C)NC(=O)CCCC

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.71
HSP90AA1 P07900 1/20 0.45
FAAH O00519 4/20 0.44
HRH3 Q9Y5N1 1/20 0.44
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
GRK2 P25098 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPK1 P28482 1/20 0.41
EPHX1 P07099 1/20 0.41
MAPT P10636 3/20 0.40
KDM4E B2RXH2 1/20 0.40
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
CASP2 P42575 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL28470106 0.94 ALDH1A1 (0.75) ALDH1A1HSP90AA1FAAHHRH3KMT2A
SCHEMBL19783828 0.94 ALDH1A1 (0.75) ALDH1A1HSP90AA1FAAHHRH3KMT2A
SCHEMBL27886560 0.94 ALDH1A1 (0.75) ALDH1A1HSP90AA1FAAHHRH3KMT2A
SCHEMBL22670505 0.86 ALDH1A1 (0.69) ALDH1A1HSP90AA1FAAHHRH3KMT2A
SCHEMBL31216171 0.84 ALDH1A1 (0.66) ALDH1A1KMT2AMEN1LMNAPOLB
SCHEMBL20440475 0.83 ALDH1A1 (0.64) ALDH1A1HSP90AA1FAAHHRH3KMT2A
SCHEMBL7885120 0.83 ALDH1A1 (0.70) ALDH1A1HSP90AA1FAAHHRH3KMT2A
SCHEMBL5354462 0.83 ALDH1A1 (0.70) ALDH1A1HSP90AA1FAAHHRH3KMT2A
SCHEMBL14938581 0.83 ALDH1A1 (0.70) ALDH1A1HSP90AA1FAAHHRH3KMT2A
SCHEMBL8746080 0.83 ALDH1A1 (0.70) ALDH1A1HSP90AA1FAAHHRH3KMT2A

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-20210253554-A1 SULFONE PYRIDINE ALKYL AMIDE-SUBSTITUTED HETEROARYL COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2021-08-19 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-20210253554-A1 SULFONE PYRIDINE ALKYL AMIDE-SUBSTITUTED HETEROARYL COMPOUNDS TYK2, JAK3, JAK2 ALDH1A1 4424/4885HSP90AA1 3683/4885FAAH 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.