SCHEMBL9364446

SCHEMBL9364446

O=C(O)Cc1c(Cl)cccc1Cl.[Na]

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 2/20 0.95
KMT2A Q03164 4/20 0.53
ADRA2A P08913 2/20 0.53
ADRA1A P35348 2/20 0.53
MEN1 O00255 2/20 0.53
LMNA P02545 1/20 0.53
CYP3A4 P08684 1/20 0.53
HTR1A P08908 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
ADRA2B P18089 1/20 0.53
ADRA2C P18825 1/20 0.53
MAOA P21397 1/20 0.53
ADRA1D P25100 1/20 0.53
HTR2A P28223 1/20 0.53
HTR2C P28335 1/20 0.53
MAPK1 P28482 1/20 0.53
CYP2C19 P33261 1/20 0.53
DRD3 P35462 1/20 0.53
OPRK1 P41145 1/20 0.53

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
SCHEMBL109215 0.98 AKR1B1 (1.00) AKR1B1KMT2AADRA2AADRA1AMEN1
Hydrochloric Acid SCHEMBL1374156 0.95 AKR1B1 (0.95) AKR1B1KMT2AADRA2AADRA1AMEN1
SCHEMBL11691926 0.85 AKR1B1 (0.77) AKR1B1KMT2AADRA2AADRA1AMEN1
SCHEMBL29933615 0.84 AKR1B1 (0.74) AKR1B1KMT2AADRA2AADRA1AMEN1
SCHEMBL29570152 0.84 AKR1B1 (0.74) AKR1B1KMT2AMEN1MAPTKDM4E
SCHEMBL13829757 0.84 AKR1B1 (0.74) AKR1B1KMT2AADRA2AADRA1AMEN1
SCHEMBL1285811 0.84 AKR1B1 (0.74) AKR1B1KMT2AMEN1MAPTKDM4E
SCHEMBL3044981 0.84 AKR1B1 (0.74) AKR1B1KMT2AADRA2AADRA1AMEN1
SCHEMBL17410055 0.84 AKR1B1 (0.74) AKR1B1KMT2AADRA2AADRA1AMEN1
SCHEMBL1035697 0.84 AKR1B1 (0.74) AKR1B1KMT2AADRA2AADRA1AMEN1

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
EP-0592569-A1 COMPOSITION AND METHOD FOR TRANSDERMAL DELIVERY OF DICLOFENAC SANO CORPORATION (US) 1994-04-20 EP disclosed
EP-0592569-A4 COMPOSITION AND METHOD FOR TRANSDERMAL DELIVERY OF DICLOFENAC. SANO CORP (US) 1994-03-15 EP disclosed
WO-1993000873-A1 COMPOSITION AND METHOD FOR TRANSDERMAL DELIVERY OF DICLOFENAC SANO CORPORATION (US) 1993-01-21 WO disclosed