SCHEMBL5855387

SCHEMBL5855387

C[SiH](C)[Hf](Cl)(Cl)(NC=O)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PNMT P11086 1/20 0.35
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
PGR P06401 1/20 0.32
MAP3K9 P80192 1/20 0.30
MAP3K11 Q16584 1/20 0.30
DRD2 P14416 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 1/20 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
SCHEMBL5853070 0.85 NPC1 (0.36) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL5853400 0.81 RAB9A (0.51) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL7210057 0.81 NPC1 (0.38) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL5855486 0.78 NPC1 (0.42) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL5854944 0.78 RAB9A (0.42) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL5853476 0.78 RAB9A (0.42) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL7197705 0.78 PNMT (0.42) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL6836896 0.78 NPC1 (0.36) NPC1RAB9APNMTPGR
SCHEMBL5853840 0.77 NPC1 (0.44) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL5855469 0.77 PNMT (0.36) NPC1RAB9APNMTPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed