SCHEMBL7297885

SCHEMBL7297885

CC(O)S(=O)(=O)c1ccncc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.40
▸ PTGS2 P35354 2/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ LARS1 Q9P2J5 1/20 0.35
▸ ABCC9 O60706 2/20 0.33
▸ ABCC8 Q09428 2/20 0.33
▸ KCNJ11 Q14654 2/20 0.33
▸ KCNJ8 Q15842 2/20 0.33
▸ NAMPT P43490 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ NAPRT Q6XQN6 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL6096851 0.82 HPGD (0.38) HPGDPTGS2MAOAMAOBKMT2A
SCHEMBL7297876 0.80 HPGD (0.37) HPGDPTGS2MAOAMAOBKMT2A
SCHEMBL3328706 0.77 TSHR (0.48) HPGDKMT2AGAANPC1LMNA
SCHEMBL5335059 0.76 GAA (0.52) HPGDKMT2AGAALMNAALDH1A1
SCHEMBL11595081 0.74 MMP1 (0.30) —
SCHEMBL32038 0.74 MMP2 (0.55) KMT2A
SCHEMBL7295928 0.74 HCAR2 (0.33) NAPRT
SCHEMBL7758469 0.74 TSHR (0.52) KMT2AGAALMNAALDH1A1
SCHEMBL9646612 0.74 MMP13 (0.34) KMT2AALDH1A1
SCHEMBL3626861 0.73 KMT2A (0.34) HPGDPTGS2MAOAMAOBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5652247-A VASOPRESSIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD (JP) 1997-07-29 — — US disclosed
US-5436254-A Vaopressin antagonists OTSUKA PHARMACEUTICAL COMPANY, LTD. (JP) 1995-07-25 — — US disclosed
EP-0602209-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-22 — — EP disclosed
EP-0382185-B1 Carbostyril derivatives OTSUKA PHARMA CO LTD (JP) 1994-06-15 — — EP disclosed
WO-1994001113-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-01-20 — — WO disclosed
US-5225402-A Vasopressin antagonist, vasodilation, hypotensive, diuretics and anticoagulants OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-06 — — US disclosed
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 — — EP disclosed
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