SCHEMBL5487612

SCHEMBL5487612

c1ccc2c(c1)Sc1ccccc1N2c1nccs1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.43
MAOA P21397 1/20 0.42
TDP1 Q9NUW8 3/20 0.40
KDM1A O60341 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
G6PD P11413 1/20 0.40
PKM P14618 1/20 0.40
MPI P34949 1/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40
KAT2B Q92831 1/20 0.40
BCHE P06276 2/20 0.39
GLA P06280 2/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL5483566 0.77 HSD17B10 (0.42) HSD17B10TDP1ALDH1A1MAPTKDM4E
SCHEMBL28577558 0.73 KDM1A (0.50) HSD17B10MAOAKDM1AALDH1A1GAA
SCHEMBL2498937 0.70 SMN1; SMN2 (0.51) HSD17B10MAOAKDM1AALDH1A1KDM4E
SCHEMBL20837192 0.70 MAOA (0.45) HSD17B10MAOAKDM1AALDH1A1BCHE
SCHEMBL28199867 0.70 HSD17B10 (0.56) HSD17B10TDP1ALDH1A1MAPTKDM4E
SCHEMBL29204149 0.69 HSD17B10 (0.73) HSD17B10TDP1ALDH1A1MAPTKDM4E
SCHEMBL30486192 0.69 HSD17B10 (0.73) HSD17B10TDP1ALDH1A1MAPTKDM4E
SCHEMBL9525846 0.69 HPGD (0.53) HSD17B10TDP1ALDH1A1MAPTKDM4E
SCHEMBL2499041 0.68 MAOA (0.47) MAOATDP1KDM1AALDH1A1MAPT
SCHEMBL31314498 0.68 MAOA (0.47) MAOATDP1KDM1AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100349908-C Organic metal complex, electroluminescent material using the complex and ectroluminescent element using the complex SEMICONDUCTOR ENERGY LAB (JP) 2007-11-21 CN disclosed
US-7176307-B2 Organometal complex, electroluminescence material using the complex, and electroluminescence element using the complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2007-02-13 US disclosed
US-20060106211-A1 Organometal complex, electroluminescence material using the complex, and electroluminescence element using the complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2006-05-18 US disclosed
US-7041390-B2 Organometal complex, electroluminescence material using the complex, and electroluminescence element using the complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2006-05-09 US disclosed
CN-1751055-A Organic metal complex, electroluminescent material using the complex and ectroluminescent element using the complex SEMICONDUCTOR ENERGY LAB (JP) 2006-03-22 CN disclosed
EP-1598361-A1 ORGANIC METAL COMPLEX, ELECTROLUMINESCENT MATERIAL USING THE COMPLEX AND ECTROLUMINESCENT ELEMENT USING THE COMPLEX SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2005-11-23 EP disclosed
US-20050006625-A1 Organometal complex, electroluminescence material using the complex, and electroluminescence element using the complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2005-01-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050006625-A1 Organometal complex, electroluminescence material using the complex, and electroluminescence element using the complex HSF1, ELP1, RPL19 HSD17B10 936/4885MAOA 2941/4885TDP1 3827/4885
US-20060106211-A1 Organometal complex, electroluminescence material using the complex, and electroluminescence element using the complex ELP1, HSF1, EMC1 HSD17B10 891/4885MAOA 2995/4885TDP1 3277/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.