SCHEMBL6271963

SCHEMBL6271963

O=c1onc(-c2ccc(Cl)cc2)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.48
GAA P10253 2/20 0.48
NLRP3 Q96P20 1/20 0.43
ALDH1A1 P00352 4/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
LMNA P02545 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 4/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 3/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 4/20 0.41
TNKS O95271 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41

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
SCHEMBL7892961 0.85 NPSR1 (0.48) NPSR1GAAALDH1A1CYP1A2LMNA
SCHEMBL10790983 0.75 ENPP3 (0.53) MAPTENPP3
SCHEMBL706420 0.70 ATM (0.73) NPSR1GAAALDH1A1LMNAKMT2A
SCHEMBL31014288 0.70 ATM (0.73) NPSR1GAAALDH1A1LMNAKMT2A
SCHEMBL7890686 0.69 LRRK2 (0.44) GAAALDH1A1CYP1A2LMNAHTT
SCHEMBL28346770 0.68 ESR1 (0.59) ALDH1A1KMT2AMEN1MAPTHTR2A
SCHEMBL28430363 0.67 ESR1 (0.56) LMNA
SCHEMBL31359722 0.67 KMT2A (0.57) NPSR1GAANLRP3ALDH1A1CYP1A2
SCHEMBL1396090 0.67 KMT2A (0.57) NPSR1GAANLRP3ALDH1A1CYP1A2
SCHEMBL1789226 0.67 NPSR1 (0.64) NPSR1GAAALDH1A1CYP1A2CYP2C9

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
WO-2018158777-A1 IMPROVED PROCESS FOR THE PREPARATION OF CHLORTHALIDONE MYLAN LABORATORIES LIMITED (IN) 2018-09-07 WO disclosed
WO-2005065046-A2 AN EFFICIENT INDUSTRIAL PROCESS FOR 3-HYDROXY-3-(3’-SULFAMYL-4’-CHLOROPHENYL)PHTALIMIDINE IPCA LABORATORIES LIMITED (IN) 2005-07-21 WO disclosed
EP-0051215-B1 METHODS AND INTERMEDIATES FOR THE SYNTHESIS OF 3-ARYL-3-HYDROXY-PHTHALIMIDINES USV PHARMACEUTICAL CORPORATION (US) 1987-03-18 EP disclosed
US-4477675-A SULFONATION OF A 3-PHENYLPHTHALIMIDINE; OXIDATION TO OBTAIN THE 3-HYDROXY DERIVATIVE USV PHARMACEUTICAL CORPORATION (US) 1984-10-16 US disclosed
US-4331600-A 3-/HALOSULFONYL OR SULFAMYLPHENYL/PHTHALIMIDINE, HYPOTENSIVE AGENTS, DIURETICS USV PHARMACEUTICAL CORPORATION (US) 1982-05-25 US disclosed
EP-0051215-A2 Methods and intermediates for the synthesis of 3-aryl-3-hydroxy-phthalimidines USV PHARMACEUTICAL CORPORATION (US) 1982-05-12 EP disclosed
EP-0051217-A1 Oxidation process USV PHARMACEUTICAL CORPORATION (US) 1982-05-12 EP disclosed