SCHEMBL31527723

SCHEMBL31527723

O=[N+]([O-])c1ccc(N[SH](=O)=O)c(Cl)c1.[Na]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 1/20 0.55
▸ CRHR2 Q13324 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ MAPT P10636 6/20 0.48
▸ KMT2A Q03164 6/20 0.48
▸ MEN1 O00255 5/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ PKM P14618 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ ALDH1A1 P00352 5/20 0.47
▸ LMNA P02545 3/20 0.47
▸ CYP2C9 P11712 2/20 0.47
▸ AURKA O14965 1/20 0.47
▸ PDPK1 O15530 1/20 0.47
▸ JAK2 O60674 1/20 0.47
▸ GMNN O75496 1/20 0.47
▸ EGFR P00533 1/20 0.47
▸ TP53 P04637 1/20 0.47

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
SCHEMBL31527865 0.80 ALDH1A1 (0.55) CRHBPCRHR2MAPTKMT2AMEN1
SCHEMBL28657713 0.79 HSD17B10 (0.62) CRHBPCRHR2HSD17B10MAPTKMT2A
SCHEMBL11656718 0.77 HSD17B10 (0.60) CRHBPCRHR2HSD17B10MAPTKMT2A
SCHEMBL3273626 0.77 HSD17B10 (0.60) CRHBPCRHR2HSD17B10MAPTKMT2A
SCHEMBL31527961 0.77 ALDH1A1 (0.51) MAPTKMT2AMEN1NPC1MAPK1
SCHEMBL31527794 0.77 ALDH1A1 (0.55) MAPTKMT2AMEN1NPC1RAB9A
SCHEMBL8473024 0.76 HSD17B10 (0.58) CRHBPCRHR2HSD17B10MAPTKMT2A
Hydrochloric Acid SCHEMBL1118002 0.76 HSD17B10 (0.58) CRHBPCRHR2HSD17B10MAPTKMT2A
SCHEMBL7532541 0.75 HSD17B10 (0.56) CRHBPCRHR2HSD17B10MAPTKMT2A
SCHEMBL7532533 0.75 HSD17B10 (0.56) CRHBPCRHR2HSD17B10MAPTKMT2A

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
CN-119968127-A Animal food compositions with improved palatability and customizable properties and methods of making the same 玛氏公司 2025-05-09 — — CN disclosed
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