SCHEMBL8319150

SCHEMBL8319150

CCCCC(C)O[SiH](C)C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.35
OPRM1 P35372 1/20 0.33
FAAH O00519 5/20 0.32
ALDH1A1 P00352 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
TSHR P16473 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP3A4 P08684 1/20 0.30
FDPS P14324 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
SCHEMBL6889088 0.91 OPRM1 (0.41) DNM1OPRM1FAAHALDH1A1CNR1
SCHEMBL27588869 0.91 OPRM1 (0.41) DNM1OPRM1FAAHALDH1A1CNR1
SCHEMBL31253357 0.91 OPRM1 (0.41) DNM1OPRM1FAAHALDH1A1CNR1
SCHEMBL31253355 0.91 OPRM1 (0.41) DNM1OPRM1FAAHALDH1A1CNR1
SCHEMBL7116071 0.91 OPRM1 (0.41) DNM1OPRM1FAAHALDH1A1CNR1
SCHEMBL27606852 0.91 OPRM1 (0.41) DNM1OPRM1FAAHALDH1A1CNR1
SCHEMBL30175004 0.84
SCHEMBL28924408 0.82 DNM1 (0.36) DNM1OPRM1FAAHALDH1A1TDP1
SCHEMBL29240681 0.80 PRKD3 (0.39) DNM1FAAHCNR1CNR2CA2
SCHEMBL8402447 0.79 DNM1 (0.38) DNM1OPRM1ALDH1A1TDP1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920425-A1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1999-06-09 EP disclosed
EP-0874843-A1 NOVEL SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL) 1,4]DIAZEPANES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1998-11-04 EP disclosed
WO-1997022604-A1 NOVEL SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL)[1,4]DIAZEPANES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1997-06-26 WO disclosed
WO-1997019074-A1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1997-05-29 WO disclosed
EP-0532423-A1 Novel unsaturated acyclic phosphonate derivatives of purine and pyrimidine MERRELL DOW PHARMACEUTICALS INC. (US) 1993-03-17 EP disclosed