SCHEMBL8766878

SCHEMBL8766878

C=CCCCCc1ccc(C)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.41
HDAC1 Q13547 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HDAC4 P56524 1/20 0.38
IGF1R P08069 2/20 0.37
ALOX15 P16050 2/20 0.37
MAPT P10636 1/20 0.37
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
CYP4Z1 Q86W10 1/20 0.36
CYP4F11 Q9HBI6 1/20 0.36
CYP4F12 Q9HCS2 1/20 0.36
PSMB5 P28074 1/20 0.35
TSHR P16473 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
SCHEMBL12802050 0.94 SKP2 (0.42) SKP2HDAC1TDP1USP2ALDH1A1
SCHEMBL12802112 0.86 MAPT (0.36) SKP2TDP1ALDH1A1MAPTCYP3A4
SCHEMBL6056799 0.84 ESR1 (0.52) ALDH1A1HPGDIGF1RALOX15MAPT
SCHEMBL19391320 0.83 DAO (0.41) SKP2HDAC1TDP1USP2ALDH1A1
SCHEMBL31556195 0.82 SKP2 (0.50) SKP2ALDH1A1IGF1RALOX15CYP3A4
SCHEMBL6056763 0.82 ALDH1A1 (0.47) TDP1ALDH1A1HPGDMAPTTSHR
SCHEMBL1611829 0.81 SKP2 (0.41) SKP2IGF1RALOX15CYP3A4CYP2D6
SCHEMBL1611204 0.80 SKP2 (0.40) SKP2IGF1RALOX15CYP3A4CYP2D6
SCHEMBL1611860 0.80 SKP2 (0.40) SKP2IGF1RALOX15CYP3A4CYP2D6
SCHEMBL8827605 0.80 CDK1 (0.42) SKP2IGF1RALOX15CYP3A4CYP2D6

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-0575081-B1 Side-chain alkylation method SUMIKIN CHEMICAL (JP) 1997-08-20 EP disclosed
EP-0578369-B1 Production process of 1,4,5,8-naphthalene tetracarboxylic acid SUMIKIN CHEMICAL (JP) 1996-05-22 EP disclosed
US-5414174-A Reacting unsaturated hydrocarbon with alkyl aromatic compound SUMIKIN CHEMICAL CO., LTD. (JP) 1995-05-09 US disclosed
US-5354899-A Production process of 1,4,5,8-naphthalene tetracarboxylic acid SUMIKIN CHEMICAL CO. (JP) 1994-10-11 US disclosed
EP-0578369-A2 Production process of 1,4,5,8-naphthalene tetracarboxylic acid SUMIKIN CHEMICAL CO., LTD. (JP) 1994-01-12 EP disclosed
EP-0575081-A2 Side-chain alkylation method SUMIKIN CHEMICAL CO., LTD. (JP) 1993-12-22 EP disclosed