SCHEMBL8985363

SCHEMBL8985363

C=CCCCCc1cc(C)ccc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.52
HPGD P15428 4/20 0.38
ALDH1A1 P00352 4/20 0.38
TDP1 Q9NUW8 2/20 0.38
USP2 O75604 1/20 0.38
TLR8 Q9NR97 1/20 0.36
KDM4E B2RXH2 2/20 0.34
GAA P10253 2/20 0.34
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
DRD2 P14416 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
HTR2A P28223 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
SCHEMBL12802144 0.95 TAAR1 (0.53) TAAR1HPGDALDH1A1TDP1TLR8
SCHEMBL7734929 0.87 TAAR1 (0.57) TAAR1HPGDALDH1A1TDP1KDM4E
SCHEMBL1611560 0.82 TAAR1 (0.52) TAAR1HPGDALDH1A1TDP1KDM4E
SCHEMBL1611407 0.81 TAAR1 (0.50) TAAR1HPGDALDH1A1TDP1KDM4E
SCHEMBL1612162 0.81 TAAR1 (0.50) TAAR1HPGDALDH1A1TDP1KDM4E
SCHEMBL12802432 0.80 TLR8 (0.40) TAAR1ALDH1A1TDP1USP2TLR8
SCHEMBL1612323 0.79 TAAR1 (0.57) TAAR1HPGDALDH1A1TDP1KDM4E
SCHEMBL1611851 0.78 TAAR1 (0.55) TAAR1HPGDALDH1A1TDP1KDM4E
SCHEMBL1610404 0.78 TAAR1 (0.55) TAAR1HPGDALDH1A1TDP1KDM4E
SCHEMBL1610683 0.78 TAAR1 (0.55) TAAR1HPGDALDH1A1TDP1KDM4E

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
EP-0578369-B1 Production process of 1,4,5,8-naphthalene tetracarboxylic acid SUMIKIN CHEMICAL (JP) 1996-05-22 EP 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