SCHEMBL8766388

SCHEMBL8766388

Ic1cc2c3c(cccc3c1)C=C2

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
DNMT1 P26358 1/20 0.31
CACNA1B Q00975 1/20 0.31
APBA1 Q02410 1/20 0.31
KMT2A Q03164 1/20 0.31
MCL1 Q07820 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
CYP1B1 Q16678 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL8714064 0.76 CYP1A2 (0.39) ALDH1A1MEN1DNMT1CACNA1BAPBA1
SCHEMBL29575794 0.75 ALDH1A1 (0.53) ALDH1A1MEN1DNMT1KMT2AMCL1
SCHEMBL26037 0.75 ALDH1A1 (0.53) ALDH1A1MEN1DNMT1KMT2AMCL1
SCHEMBL8872842 0.75 ALDH1A1 (0.53) ALDH1A1MEN1DNMT1KMT2AMCL1
SCHEMBL5372675 0.74 ALDH1A1 (0.31) ALDH1A1MEN1DNMT1CACNA1BAPBA1
SCHEMBL5033508 0.74 CYP2A6 (0.38) ALDH1A1MEN1DNMT1CACNA1BAPBA1
SCHEMBL120783 0.74 ALDH1A1 (0.40) ALDH1A1MEN1DNMT1CACNA1BAPBA1
SCHEMBL551412 0.74 NPSR1 (0.42) ALDH1A1MEN1DNMT1CACNA1BAPBA1
SCHEMBL5031545 0.74 CYP1A2 (0.39) ALDH1A1MEN1DNMT1CACNA1BAPBA1
SCHEMBL5376089 0.74 MPO (0.41) ALDH1A1MEN1DNMT1CACNA1BAPBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505972-B1 Process for producing styrenic copolymer IDEMITSU KOSAN CO (JP) 1997-06-11 EP disclosed
EP-0505972-A2 Process for producing styrenic copolymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-09-30 EP disclosed