SCHEMBL6966671

SCHEMBL6966671

O=C(CCCl)N1CCc2ccc(Cl)cc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.64
DRD2 P14416 6/20 0.61
DRD4 P21917 5/20 0.61
XIAP P98170 1/20 0.55
BIRC2 Q13490 1/20 0.55
TSHR P16473 1/20 0.53
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
MAPT P10636 1/20 0.50
HTR2A P28223 2/20 0.48
HTR2C P28335 2/20 0.48
HSD17B3 P37058 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
HTR2B P41595 1/20 0.46
RHOC P08134 1/20 0.46
RHOA P61586 1/20 0.46
ADRA1D P25100 1/20 0.45
ADRA1A P35348 1/20 0.45
ADRA1B P35368 1/20 0.45
ALDH1A1 P00352 1/20 0.45

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
SCHEMBL11224906 0.88 NOTUM (0.68) NOTUMDRD2DRD4XIAPBIRC2
SCHEMBL8895360 0.85 NOTUM (0.68) NOTUMDRD2DRD4XIAPBIRC2
SCHEMBL6961783 0.84 DRD2 (0.58) NOTUMDRD2DRD4XIAPTSHR
SCHEMBL6960804 0.84 TSHR (0.51) NOTUMDRD2DRD4TSHRMEN1
SCHEMBL6960678 0.84 DRD2 (0.58) NOTUMDRD2DRD4XIAPBIRC2
SCHEMBL6961286 0.82 NOTUM (0.48) NOTUMDRD2DRD4MEN1KMT2A
SCHEMBL27447403 0.81 TSHR (0.48) NOTUMDRD2DRD4XIAPBIRC2
SCHEMBL6962584 0.81 BIRC2 (0.57) NOTUMDRD2XIAPBIRC2TSHR
SCHEMBL4637311 0.80 TSHR (0.81) NOTUMDRD2DRD4TSHRMEN1
SCHEMBL8901483 0.80 NOTUM (0.65) NOTUMDRD2DRD4XIAPBIRC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807631-B1 Tricyclic compounds having fungicidal activity, their preparation and their use SANKYO CO (JP) 2003-03-12 EP disclosed
CN-1059904-C Tricyclic compounds having fungicidal activity, their preparation and their use SANKYO CO (JP) 2000-12-27 CN disclosed
US-5981752-A Tricyclic compounds having fungicidal activity, their preparation and their use SANKYO COMPANY, LIMITED (JP) 1999-11-09 US disclosed
US-5773618-A PYRROLOQUINOLINONE DERIVATIVES SANKYO COMPANY, LIMITED (JP) 1998-06-30 US disclosed
CN-1172809-A Tricyclic compounds having fungicidal activity, their preparation and their use SANKYO CO (JP) 1998-02-11 CN disclosed
EP-0807631-A1 Tricyclic compounds having fungicidal activity, their preparation and their use SANKYO COMPANY LIMITED (JP) 1997-11-19 EP disclosed