SCHEMBL9752000

SCHEMBL9752000

Cc1ccc(Cc2ccccc2O)c(O)c1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.64
AMY1A P0DUB6 1/20 0.53
MAPT P10636 4/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
IDH1 O75874 1/20 0.49
HPGD P15428 1/20 0.49
KEAP1 Q14145 1/20 0.47
TRPA1 O75762 1/20 0.46
ALOX5 P09917 1/20 0.44
HTT P42858 1/20 0.44
CNR2 P34972 1/20 0.43
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
HIF1A Q16665 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
AKR1B1 P15121 1/20 0.41

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
SCHEMBL51100 0.89 AMY1A (0.57) HSPA5AMY1AMAPTHPGDTRPA1
SCHEMBL7460688 0.89 HSPA5 (0.59) HSPA5AMY1AMAPTSMN1; SMN2IDH1
SCHEMBL10471927 0.88 AMY1A (0.69) HSPA5AMY1AMAPTSMN1; SMN2IDH1
SCHEMBL31083107 0.82 ALOX5 (0.67) MAPTIDH1HPGDKEAP1TRPA1
SCHEMBL6338698 0.82 HSPA5 (0.55) HSPA5AMY1AMAPTSMN1; SMN2IDH1
SCHEMBL29901003 0.80 AMY1A (0.64) HSPA5AMY1AMAPTSMN1; SMN2IDH1
SCHEMBL19621170 0.80 AMY1A (0.75) HSPA5AMY1AMAPTSMN1; SMN2IDH1
SCHEMBL30375225 0.80 AMY1A (0.69) HSPA5AMY1AMAPTSMN1; SMN2IDH1
SCHEMBL29290539 0.80 AMY1A (0.69) HSPA5AMY1AMAPTSMN1; SMN2IDH1
SCHEMBL7758427 0.80 AMY1A (0.69) HSPA5AMY1AMAPTSMN1; SMN2IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210351361-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-11-11 US disclosed
EP-0439607-A4 NOVEL GLYOXYLATES AND HERBICIDAL AND PLANT GROWTH REGULANT ACTIVITY OF GLYOXYLATES 1991-12-04 EP disclosed
EP-0439607-A1 NOVEL GLYOXYLATES AND HERBICIDAL AND PLANT GROWTH REGULANT ACTIVITY OF GLYOXYLATES ISK BIOSCIENCES CORPORATION (US) 1991-08-07 EP disclosed
WO-1991000009-A1 NOVEL GLYOXYLATES AND HERBICIDAL AND PLANT GROWTH REGULANT ACTIVITY OF GLYOXYLATES FERMENTA ASC CORPORATION (US) 1991-01-10 WO disclosed
US-4976770-A POSTEMERGENCE, PREEMERGENCE HERBICIDES FERMENTA ASC CORPORATION (US) 1990-12-11 US disclosed