SCHEMBL3786597

SCHEMBL3786597

CC(=O)SOc1c(N)cccc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 2/20 0.43
BACE1 P56817 3/20 0.39
LMNA P02545 4/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
PKM P14618 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
BCAT2 O15382 1/20 0.38
HNF4A P41235 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
HPGD P15428 2/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL3789085 0.91 KDR (0.35) ALDH1A1HSD17B10LMNAKDM4EMAPT
SCHEMBL3784621 0.88 MAP4K4 (0.39) ALDH1A1KDM4EMAPTBRD4SMN1; SMN2
SCHEMBL3791040 0.88 ALDH1A1 (0.42) ALDH1A1HSD17B10LMNAKDM4EMAPT
SCHEMBL3790313 0.80 NCOA1 (0.41) ALDH1A1HSD17B10BACE1LMNAKDM4E
SCHEMBL3786215 0.80 BACE1 (0.57) ALDH1A1HSD17B10BACE1LMNAKDM4E
SCHEMBL3788301 0.77 ALDH1A1 (0.44) ALDH1A1HSD17B10BACE1KDM4EMAPT
SCHEMBL3787831 0.77 ALDH1A1 (0.41) ALDH1A1HSD17B10LMNAKDM4EMAPT
SCHEMBL3789887 0.76 MAPT (0.38) ALDH1A1HSD17B10LMNAKDM4EMAPT
SCHEMBL3783387 0.75 BACE1 (0.44) ALDH1A1HSD17B10BACE1LMNAKDM4E
SCHEMBL3787218 0.74 ALDH1A1 (0.41) ALDH1A1HSD17B10LMNAMAPTPKM

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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP 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-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 ALDH1A1 4339/4885HSD17B10 1100/4885BACE1 925/4885

“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.