SCHEMBL7608091

SCHEMBL7608091

COC(=O)c1c2c(c3ccccc3c1C)OC(c1ccccc1)(c1ccccc1)C=C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NR4A2 P43354 1/20 0.36
GRM6 O15303 1/20 0.36
GRM5 P41594 1/20 0.36
LMNA P02545 3/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 2/20 0.35
IDO1 P14902 1/20 0.35
PTPN1 P18031 1/20 0.35
PTGS1 P23219 1/20 0.34
MAPK1 P28482 1/20 0.34
ALOX5 P09917 1/20 0.34
ALDH1A1 P00352 2/20 0.33
RAB9A P51151 2/20 0.33
GPR84 Q9NQS5 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HPGD P15428 1/20 0.33
DHODH Q02127 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
SCHEMBL10102251 0.93 SMN1; SMN2 (0.37) SMN1; SMN2MEN1KMT2ANR4A2GRM6
SCHEMBL5159521 0.92 SMN1; SMN2 (0.35) SMN1; SMN2MEN1KMT2ANR4A2GRM6
SCHEMBL8978512 0.91 ATM (0.41) SMN1; SMN2MEN1KMT2ANR4A2GRM6
SCHEMBL10102254 0.88 ATM (0.39) SMN1; SMN2MEN1KMT2AHTTALDH1A1
SCHEMBL5644282 0.88 ALDH1A1 (0.39) SMN1; SMN2MEN1KMT2ANR4A2LMNA
SCHEMBL6931279 0.88 SMN1; SMN2 (0.46) SMN1; SMN2MEN1KMT2ALMNATSHR
SCHEMBL7001887 0.87 EGFR (0.41) SMN1; SMN2MEN1KMT2ANR4A2GRM6
SCHEMBL5649363 0.87 NCEH1 (0.37) SMN1; SMN2MEN1KMT2ANR4A2TSHR
SCHEMBL5646946 0.87 SMN1; SMN2 (0.37) SMN1; SMN2MEN1KMT2ANR4A2TSHR
SCHEMBL17929226 0.86 ATM (0.38) SMN1; SMN2MEN1KMT2ALMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1112264-B1 POLYALKOXYLATED NAPHTHOPYRANS TRANSITIONS OPTICAL INC (US) 2002-11-27 EP disclosed