SCHEMBL8468338

SCHEMBL8468338

CC1(c2ccccc2Cc2ccc(N)cc2)CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTR6 P50406 3/20 0.38
HDAC4 P56524 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34
FFAR1 O14842 1/20 0.33

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
SCHEMBL8945147 0.83 SKP2 (0.38) ALDH1A1CYP3A4TSHRTDP1HDAC4
SCHEMBL8468662 0.82 SLC6A4 (0.40) ALDH1A1CYP3A4TSHRTDP1HTR6
SCHEMBL8945419 0.82 RXRA (0.37) ALDH1A1TSHRHDAC4SLC6A4
SCHEMBL8945164 0.82 HDAC4 (0.41) ALDH1A1CYP3A4TSHRHDAC4SLC6A4
SCHEMBL8578668 0.80 SLC6A4 (0.37) ALDH1A1CYP3A4TSHRTDP1HTR6
SCHEMBL8944994 0.80 HDAC4 (0.34) CYP3A4HDAC4
SCHEMBL8578897 0.78 CNR2 (0.38) HTR6HDAC4SLC6A4
SCHEMBL8575971 0.77 SLC6A4 (0.38) HDAC4SLC6A4
SCHEMBL8945298 0.76 CNR1 (0.39) HDAC4SLC6A4
SCHEMBL8945495 0.76 CNR1 (0.39) HDAC4SLC6A4

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-5907005-A SUITABLE FOR PRODUCING A LIQUID CRYSTAL ALIGNING FILM WITH SPECIFIC THICKNESS CONSISTS OF POLYAMIC ACID OR POLYIMIDE, AND A SOLVENT CONSISTS OF N-METHYL-PYRROLIDONE AND DIMETHYL IMIDAZOLIDINONE, AN ALKYL LACTATE AND AN ETHER CHISSO CORPORATION (JP) 1999-05-25 US disclosed
US-5798810-A RUBBING, IRRADIATING AND SEALING CHISSO CORPORATION (JP) 1998-08-25 US disclosed
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