SCHEMBL28574029

SCHEMBL28574029

O=S(=O)(OCCCCn1nnc2ccccc21)c1ccccc1.[NaH]

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC9A1 P19634 8/20 0.53
▸ EGLN3 Q9H6Z9 1/20 0.49
▸ P2RX7 Q99572 1/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ NPC1 O15118 3/20 0.48
▸ MAPT P10636 1/20 0.48
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ GRM2 Q14416 1/20 0.43

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
SCHEMBL14336029 0.83 SLC9A1 (0.53) SLC9A1EGLN3RAB9ANPC1MAPT
SCHEMBL4346795 0.74 SLC9A1 (0.63) SLC9A1EGLN3P2RX7RAB9ANPC1
SCHEMBL14796568 0.74 SLC9A1 (0.79) SLC9A1EGLN3P2RX7RAB9ANPC1
SCHEMBL5945104 0.74 PARL (0.47) MAPTKMT2ALMNATSHR
SCHEMBL7672503 0.73 SLC9A1 (0.71) SLC9A1EGLN3P2RX7RAB9ANPC1
SCHEMBL14779172 0.72 PARL (0.46) MAPTKMT2ALMNA
SCHEMBL14779590 0.72 PARL (0.46) MAPTKMT2ALMNA
SCHEMBL28698473 0.72 MGAM (0.43) SLC9A1TSHR
Sulfuric Acid SCHEMBL31557704 0.72 SLC9A1 (0.83) SLC9A1EGLN3RAB9ANPC1MAPT
SCHEMBL730645 0.72 SLC9A1 (0.70) SLC9A1EGLN3P2RX7RAB9ANPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115768265-A Improvement of foliar fertilizer 易乐施国际有限公司 2023-03-07 — — CN claimed
CN-115768265-A Improvement of foliar fertilizer 易乐施国际有限公司 2023-03-07 — — CN disclosed
CN-108473484-B Compounds useful as TRPM8 modulators 弗门尼舍公司 2021-06-29 — — CN disclosed
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