SCHEMBL8945308

SCHEMBL8945308

CCCC1(Cc2ccc(N)cc2)CCCCC1c1ccccc1F

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.40
RCOR1 Q9UKL0 1/20 0.40
NOS3 P29474 2/20 0.34
NOS1 P29475 2/20 0.34
NOS2 P35228 2/20 0.34
SLC10A2 Q12908 1/20 0.33
HTR6 P50406 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL8944930 0.91 KDM1A (0.44) KDM1ARCOR1NOS3NOS1NOS2
SCHEMBL8945071 0.87 SLC10A2 (0.33) NOS3NOS1NOS2SLC10A2HTR6
SCHEMBL8945087 0.86 SLC10A2 (0.35) SLC10A2HTR6KDM4E
SCHEMBL8945429 0.85 SLC10A2 (0.32) SLC10A2HTR6
SCHEMBL8945333 0.82 KDM1A (0.41) KDM1ARCOR1NOS3NOS1NOS2
SCHEMBL8945039 0.81 SLC10A2 (0.35) NOS3NOS1NOS2SLC10A2HTR6
SCHEMBL8945145 0.80 SLC10A2 (0.33) SLC10A2HTR6
SCHEMBL8945347 0.79 CYP19A1 (0.33) SLC10A2HTR6
SCHEMBL8945330 0.79 CYP19A1 (0.33) SLC10A2HTR6
SCHEMBL8945247 0.79 CYP19A1 (0.33) SLC10A2HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5501884-A Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1996-03-26 US disclosed