SCHEMBL6674827

SCHEMBL6674827

CCCCCCCCCN1C[C@H]2CCCC[C@H]2C1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GUSB P08236 2/20 0.55
EBP Q15125 1/20 0.55
SIGMAR1 Q99720 1/20 0.55
GNAI3 P08754 5/20 0.52
GNAO1 P09471 5/20 0.52
GNAI1 P63096 5/20 0.52
BCHE P06276 3/20 0.46
GBA1 P04062 1/20 0.46
GLB1 P16278 1/20 0.44

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
SCHEMBL21210655 1.00 GUSB (0.55) GUSBEBPSIGMAR1GNAI3GNAO1
SCHEMBL6674218 1.00 GUSB (0.55) GUSBEBPSIGMAR1GNAI3GNAO1
SCHEMBL6674222 1.00 GUSB (0.55) GUSBEBPSIGMAR1GNAI3GNAO1
SCHEMBL23765241 0.96 GUSB (0.55) GUSBEBPSIGMAR1GNAI3GNAO1
SCHEMBL23435369 0.89 GUSB (0.55) GUSBEBPSIGMAR1GNAI3GNAO1
SCHEMBL14877527 0.89 GNAI3 (0.64) GNAI3GNAO1GNAI1BCHE
SCHEMBL18698673 0.87 BCHE (0.55) GNAI3GNAO1GNAI1BCHE
SCHEMBL20858275 0.83 GUSB (0.59) GUSBEBPSIGMAR1GNAI3GNAO1
SCHEMBL20858345 0.83 GUSB (0.59) GUSBEBPSIGMAR1GNAI3GNAO1
SCHEMBL19275301 0.83 GUSB (0.59) GUSBEBPSIGMAR1GNAI3GNAO1

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-0899259-B1 Process for the preparation of cis-hexahydroisoindolines YUKI GOSEI YAKUHIN KOGYO KK (JP) 2004-10-13 EP disclosed
US-5932744-A Process for the preparation of cis-hexahydroisoindoline derivatives YUKI GOSEI KOGYO CO., LTD. (JP) 1999-08-03 US disclosed
EP-0899259-A1 Process for the preparation of cis-hexahydroisoindolines YUKI GOSEI KOGYO CO., LTD. (JP) 1999-03-03 EP disclosed