SCHEMBL9209985

SCHEMBL9209985

CCOC(=O)n1ncc2cc[c]cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.43
POLB P06746 2/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.35
KMT2A Q03164 3/20 0.35
HPGD P15428 2/20 0.35
ASAH1 Q13510 1/20 0.35
ELANE P08246 1/20 0.35
CYP1A2 P05177 1/20 0.34
RAB9A P51151 2/20 0.33
SLC22A12 Q96S37 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KMO O15229 1/20 0.33
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CHEK1 O14757 1/20 0.33
AURKA O14965 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
SCHEMBL2013949 0.80 CHEK1 (0.50) ASAH1ELANESLC22A12KMOCHEK1
SCHEMBL5120623 0.79 HSD17B10 (0.56) HSD17B10POLBTSHRKDM4EALDH1A1
SCHEMBL2466233 0.77 CHEK1 (0.36) ASAH1ELANESLC22A12KMOCHEK1
Hydrochloric Acid SCHEMBL2925512 0.76 CHEK1 (0.36) ASAH1ELANESLC22A12KMOCHEK1
Hydrochloric Acid SCHEMBL3871255 0.76 CHEK1 (0.36) ASAH1ELANESLC22A12KMOCHEK1
Bromide SCHEMBL2933641 0.76 CHEK1 (0.36) ASAH1ELANESLC22A12KMOCHEK1
Bromide SCHEMBL2931155 0.76 CHEK1 (0.36) ASAH1ELANESLC22A12KMOCHEK1
SCHEMBL4769167 0.74 ELANE (0.44) HSD17B10POLBTSHRMAPTKMT2A
Hydrochloric Acid SCHEMBL5049276 0.72 TSHR (0.38) HSD17B10POLBTSHRKDM4EALDH1A1
SCHEMBL30457321 0.71 CHEK1 (0.67) HSD17B10POLBTSHRKDM4EALDH1A1

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-0544218-B1 Arylindazole derivatives and their use SUMITOMO CHEMICAL CO (JP) 1995-07-26 EP disclosed
US-5266556-A Herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-30 US disclosed
EP-0544218-A1 Arylindazole derivatives and their use SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1993-06-02 EP disclosed