SCHEMBL7066941

SCHEMBL7066941

CCCCCC1CCC(C(=O)O)(c2ccc(C#N)c(C#N)c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
FFAR4 Q5NUL3 3/20 0.36
TSHR P16473 1/20 0.35
AR P10275 2/20 0.33
FFAR1 O14842 1/20 0.33
TLR7 Q9NYK1 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
SCHEMBL7066508 0.90 APP (0.39) ALDH1A1HPGDMEN1KMT2AFFAR4
SCHEMBL10874182 0.85 KMT2A (0.48) MEN1KMT2AFFAR4TSHR
SCHEMBL9195419 0.84 CTSC (0.40) ALDH1A1HPGDMEN1KMT2A
SCHEMBL5886251 0.82 APP (0.40) FFAR4
SCHEMBL10610076 0.82 MEN1 (0.45) MEN1KMT2AFFAR4TSHR
SCHEMBL11226170 0.81 KMT2A (0.49) MEN1KMT2AFFAR4TSHR
SCHEMBL7508869 0.80 AKR1C3 (0.43) MEN1KMT2ATSHR
SCHEMBL7065829 0.80 MEN1 (0.35) MEN1KMT2AFFAR4TSHR
SCHEMBL7566021 0.79 LTB4R (0.42) MEN1KMT2A
SCHEMBL7511127 0.78 MEN1 (0.48) ALDH1A1MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0673986-B1 Active matrix type liquid crystal display apparatus HITACHI LTD (JP) 2003-06-04 EP claimed
EP-1070753-A2 Liquid crystal compounds and their use in active matrix type liquid crystal display devices HITACHI, LTD. (JP) 2001-01-24 EP claimed
EP-0673986-A2 Active matrix type liquid crystal display apparatus HITACHI, LTD. (JP) 1995-09-27 EP claimed
EP-0673986-B1 Active matrix type liquid crystal display apparatus HITACHI LTD (JP) 2003-06-04 EP disclosed
EP-1070753-A2 Liquid crystal compounds and their use in active matrix type liquid crystal display devices HITACHI, LTD. (JP) 2001-01-24 EP disclosed
EP-0673986-A2 Active matrix type liquid crystal display apparatus HITACHI, LTD. (JP) 1995-09-27 EP disclosed