SCHEMBL5819964

SCHEMBL5819964

CCOCn1c(-c2ccc(C)cc2)c(C#N)c(Cl)c1C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.34
ALDH1A1 P00352 5/20 0.34
HPGD P15428 5/20 0.34
GAA P10253 3/20 0.34
GLA P06280 1/20 0.34
ATM Q13315 1/20 0.34
AR P10275 3/20 0.33
KDM4E B2RXH2 5/20 0.33
RXFP1 Q9HBX9 2/20 0.32
NPSR1 Q6W5P4 3/20 0.32
PDE9A O76083 1/20 0.31
PDE1C Q14123 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
AURKA O14965 1/20 0.31
KDR P35968 1/20 0.31
AURKB Q96GD4 1/20 0.31
KMT2A Q03164 2/20 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
SCHEMBL5812558 0.92 RXFP1 (0.36) ALDH1A1HPGDGAAGLAKDM4E
SCHEMBL5819960 0.91 KIF11 (0.35) ALDH1A1RXFP1ADORA1MAPT
SCHEMBL5812554 0.86 CTSS (0.34) HPGDRXFP1NPSR1KMT2AMEN1
SCHEMBL9271591 0.85 AR (0.38) ALDH1A1HPGDARKDM4ERXFP1
SCHEMBL9390222 0.85
SCHEMBL9390214 0.85 DRD2 (0.34) KMT2AMEN1
SCHEMBL5812533 0.85 ADORA1 (0.33) ALDH1A1HPGDGAAGLAKDM4E
SCHEMBL9567369 0.83 KIF11 (0.33) ALDH1A1RXFP1ADORA1MAPT
SCHEMBL9567361 0.83 RXFP1 (0.35) ALDH1A1HPGDGAAGLAKDM4E
SCHEMBL9015078 0.81 KDM4E (0.37) ALDH1A1HPGDGAAGLAKDM4E

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
EP-0895839-B1 Arylpyrroles for the protection of wood, wood products and wood structures from insect attack BASF AG (DE) 2006-09-20 EP claimed
EP-0895717-B1 Arylpyrroles for subterranean termite control BASF AG (DE) 2003-05-28 EP claimed
EP-0895717-A1 Arylpyrroles for subterranean termite control American Cyanamid Company (US) 1999-02-10 EP claimed
EP-0895839-B1 Arylpyrroles for the protection of wood, wood products and wood structures from insect attack BASF AG (DE) 2006-09-20 EP disclosed
EP-0895717-B1 Arylpyrroles for subterranean termite control BASF AG (DE) 2003-05-28 EP disclosed
US-6077863-A TREATING WOOD OR WOOD PRODUCT OR SOIL SURROUNDED WITH ARYLPYRROLE INSECTICIDE, SPECIALLY TO KILL THE TERMITES AND CARPENTER ANTS AMERICAN CYANAMID COMPANY (US) 2000-06-20 US disclosed
US-6071951-A APPLYING SUBSTITUTED PYRROLE INSECTICIDES TO INFESTED SOILS OR ENVIRONMENTS AMERICAN CYANAMID COMPANY (US) 2000-06-06 US disclosed
EP-0895717-A1 Arylpyrroles for subterranean termite control American Cyanamid Company (US) 1999-02-10 EP disclosed