SCHEMBL7349196

SCHEMBL7349196

Nc1cc(N)c(OC=O)c(N)c1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL7430291 0.75 ALDH1A1 (0.38) KDM4ETDP1
SCHEMBL15626625 0.72 ALDH1A1 (0.37) MEN1KMT2A
SCHEMBL15358720 0.72 ALDH1A1 (0.32) MEN1KMT2A
SCHEMBL12040568 0.72 CA1 (0.42) KDM4ETDP1
SCHEMBL28406606 0.70 ALDH1A1 (0.31)
SCHEMBL28459787 0.70 ALDH1A1 (0.44) KDM4EMEN1KMT2ATDP1
SCHEMBL12040540 0.69 DGAT1 (0.31)
SCHEMBL27687299 0.67 NR4A1 (0.33)
SCHEMBL7290933 0.65 ALDH1A1 (0.36) KDM4EMEN1KMT2ATDP1
SCHEMBL16608098 0.65 ALDH1A1 (0.38) TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103429324-B Prevention rate raising method, the prevention rate of reverse osmosis membrane improve treatment agent and reverse osmosis membrane KURITA WATER INDUSTRIES LTD. (JP) 2016-06-01 CN disclosed
CN-104245099-A Barrier rate improving agent for reverse osmosis membrane, barrier rate improving method, and reverse osmosis membrane KURITA WATER IND LTD 2014-12-24 CN disclosed
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