SCHEMBL8157271

SCHEMBL8157271

C1=CC(C2(C3C=Cc4ccccc43)CCCC2)c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.34
HTR6 P50406 1/20 0.34

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
SCHEMBL8149561 0.98 HTR6 (0.33) HTR2AHTR6
SCHEMBL17386884 0.96 HTR2A (0.34) HTR2AHTR6
SCHEMBL7719552 0.81 HTR2A (0.36) HTR2AHTR6
SCHEMBL7164209 0.80 GAA (0.34) HTR2AHTR6
SCHEMBL2806909 0.78 BRD4 (0.31) HTR2AHTR6
SCHEMBL11034547 0.76 HTR6 (0.33) HTR2AHTR6
SCHEMBL6427869 0.76 CHRNA7 (0.31)
SCHEMBL28646220 0.76
SCHEMBL8163025 0.74 HTR6 (0.33) HTR2AHTR6
Hydrochloric Acid SCHEMBL4002087 0.73 HTR6 (0.32) HTR2AHTR6

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
US-5670681-A Process for preparing a carbon-bridged biscyclopentadiene compound HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-23 US claimed
US-6072085-A COMBINING SUBSTRATE IMINE, NUCLEOPHILIC ACTIVATOR, SILANE, METAL CATALYST, WHEREIN CATALYST CATALYZES REDUCTION OF IMINE BY HYDROSILATION MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2000-06-06 US disclosed
US-5670681-A Process for preparing a carbon-bridged biscyclopentadiene compound HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-23 US disclosed