SCHEMBL6936619

SCHEMBL6936619

Cc1ccc(S(=O)(=O)Oc2c(C)cc(/N=N/c3ccccc3/C(=C/C(=O)N(C(C)C)C(C)C)c3ccccc3)cc2C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.34
MAPT P10636 6/20 0.34
NPSR1 Q6W5P4 4/20 0.34
LMNA P02545 3/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
GAA P10253 4/20 0.33
MAPK1 P28482 2/20 0.33
PPARG P37231 1/20 0.33
PHLPP2 Q6ZVD8 1/20 0.33
PTPN1 P18031 1/20 0.33
DHODH Q02127 1/20 0.32
MYC P01106 1/20 0.32
G6PD P11413 1/20 0.32

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
SCHEMBL6936620 1.00 P2RX7 (0.34) P2RX7MAPTNPSR1LMNAMEN1
SCHEMBL6938685 0.83 KMT2A (0.44) MAPTNPSR1LMNAMEN1KMT2A
SCHEMBL6938688 0.83 KMT2A (0.44) MAPTNPSR1LMNAMEN1KMT2A
SCHEMBL6938364 0.82 LMNA (0.40) MAPTNPSR1LMNAALDH1A1CYP1A2
SCHEMBL6938363 0.82 LMNA (0.40) MAPTNPSR1LMNAALDH1A1CYP1A2
SCHEMBL10316746 0.69 CSNK2A1 (0.45) MAPTNPSR1LMNAMEN1KMT2A
SCHEMBL10355817 0.69 CSNK2A1 (0.45) MAPTNPSR1LMNAMEN1KMT2A
SCHEMBL10316745 0.69 CSNK2A1 (0.45) MAPTNPSR1LMNAMEN1KMT2A
SCHEMBL6934974 0.64 NPSR1 (0.43) MAPTNPSR1LMNAMEN1KMT2A
SCHEMBL6934690 0.64 MAPT (0.46) MAPTLMNAKMT2AALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1019358-B1 3,3-DIARYLPROPYLAMINES , THEIR USE AND PREPARATION PHARMACIA AB (SE) 2003-05-07 EP disclosed
US-6313132-B1 FOR THERAPY OF URINARY INCONTINENCE, ACETYLCHOLINE-MEDIATED DISORDER PHARMACIA AB (SE) 2001-11-06 US disclosed
EP-1019358-A1 NOVEL COMPOUNDS, THEIR USE AND PREPARATION Pharmacia & Upjohn AB (SE) 2000-07-19 EP disclosed
WO-1998043942-A1 NOVEL COMPOUNDS, THEIR USE AND PREPARATION PHARMACIA & UPJOHN AB (SE) 1998-10-08 WO disclosed