SCHEMBL5083276

SCHEMBL5083276

CC1CCC(CC2CCC(c3ccc(N)cc3)(c3ccc(N)cc3)CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CYP19A1 P11511 11/20 0.35
LMNA P02545 1/20 0.33
NSD2 O96028 1/20 0.32
CYP3A4 P08684 2/20 0.31
CYP17A1 P05093 1/20 0.31
CYP11A1 P05108 1/20 0.31
TBXAS1 P24557 1/20 0.31
PMP22 Q01453 1/20 0.31
PDE4D Q08499 1/20 0.31
PDE3A Q14432 1/20 0.31
NFKB1 P19838 1/20 0.31
NFE2L2 Q16236 1/20 0.31
HTT P42858 1/20 0.30
OPRD1 P41143 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
SCHEMBL5086212 0.92 ALDH1A1 (0.39) ALDH1A1L3MBTL1CYP19A1CYP3A4NFE2L2
SCHEMBL5085818 0.89 ALDH1A1 (0.47) ALDH1A1L3MBTL1CYP19A1LMNANSD2
SCHEMBL5086190 0.85 ALDH1A1 (0.60) ALDH1A1L3MBTL1CYP19A1LMNANSD2
SCHEMBL5082023 0.84 ALDH1A1 (0.43) ALDH1A1L3MBTL1CYP19A1LMNACYP3A4
SCHEMBL2997525 0.84 ALDH1A1 (0.57) ALDH1A1L3MBTL1CYP19A1LMNANSD2
SCHEMBL6367573 0.84 ALDH1A1 (0.40) ALDH1A1L3MBTL1CYP19A1CYP3A4CYP17A1
SCHEMBL6367577 0.84 ALDH1A1 (0.40) ALDH1A1L3MBTL1CYP19A1CYP3A4CYP17A1
SCHEMBL9350512 0.83 NFE2L2 (0.41) ALDH1A1L3MBTL1CYP19A1CYP3A4NFE2L2
SCHEMBL9350496 0.83 NFE2L2 (0.41) ALDH1A1L3MBTL1CYP19A1CYP3A4NFE2L2
SCHEMBL5082020 0.82 ALDH1A1 (0.41) ALDH1A1L3MBTL1CYP19A1LMNANFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080226845-A1 Polyamic acid-based composition and liquid crystal orienting film DAILY POLYMER CO., LTD. 2008-09-18 US claimed
US-20080226845-A1 Polyamic acid-based composition and liquid crystal orienting film DAILY POLYMER CO., LTD. 2008-09-18 US disclosed
US-6949281-B1 Varnish composition and liquid-crystal display element CHISSO CORPORATION (JP) 2005-09-27 US disclosed
US-6946169-B1 Polyamic acid composition, liquid crystal aligning film, and liquid crystal display element CHISSO CORPORATION (JP) 2005-09-20 US disclosed
US-6746730-B1 VARNISH COMPOSITION WHICH COMPRISES POLYMER COMPONENT CONTAINING TWO DIFFERENT POLYAMIC ACIDS, SOLUBLE POLYIMIDE, AND SOLVENT FOR DISSOLVING POLYMER COMPONENT CHISSO CORPORATION (JP) 2004-06-08 US disclosed
US-6685997-B1 SOLUTION CONTAINING POLYAMIC ACIDS, POLYAMIDES AND POLYIMIDES; ALIGNMENT FILM; WELL BALANCED ELECTRICAL CHARACTERISTICS; ELIMINATES IMAGE STICKING CHISSO CORPORATION (JP) 2004-02-03 US disclosed
US-6620339-B1 Providing polyimide resin with large pretilt angle; small residual voltage and high voltage holding ratio; reliable CHISSO CORPORATION (JP) 2003-09-16 US disclosed
US-6316574-B1 FOR PRODUCING ALIGNING FILMS, PROTECTION FILMS, INSULATION FILMS ELECTRICAL PROPERTIES AND RELIABILITY; FOR USE IN ELECTRONIC MATERIALS CHISSO CORPORATION (JP) 2001-11-13 US disclosed