SCHEMBL2059503

SCHEMBL2059503

Nc1c(S)ccc2c1ccc1ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.58
HSD17B10 Q99714 5/20 0.50
ALDH1A1 P00352 5/20 0.50
TSHR P16473 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
CYP2A6 P11509 1/20 0.50
PAX8 Q06710 1/20 0.43
HIF1A Q16665 2/20 0.43
CYP1B1 Q16678 1/20 0.43
HPGD P15428 3/20 0.41
CYP3A4 P08684 2/20 0.41
KEAP1 Q14145 1/20 0.41
LMNA P02545 2/20 0.40
MAPK1 P28482 2/20 0.40
MAPT P10636 1/20 0.40
APEX1 P27695 1/20 0.40
PMP22 Q01453 1/20 0.40
CYP1A2 P05177 3/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C9 P11712 2/20 0.39

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
SCHEMBL690649 0.89 HSD17B10 (0.50) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL10348051 0.79
SCHEMBL869941 0.78 HPRT1 (0.64) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL175362 0.78 HPRT1 (0.64) HPRT1HSD17B10ALDH1A1TSHRTDP1
SCHEMBL29407390 0.78 HPRT1 (0.64) HPRT1HSD17B10ALDH1A1TSHRTDP1
Hydrochloric Acid SCHEMBL9797045 0.77
SCHEMBL25510 0.76 HPRT1 (1.00) HPRT1HSD17B10ALDH1A1TSHRTDP1
Chrysene SCHEMBL9786466 0.76 HPRT1 (1.00) HPRT1HSD17B10ALDH1A1TSHRTDP1
Chrysene SCHEMBL384031 0.76 HPRT1 (1.00) HPRT1HSD17B10ALDH1A1TSHRTDP1
Chrysene SCHEMBL27115 0.76 HPRT1 (1.00) HPRT1HSD17B10ALDH1A1TSHRTDP1

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
US-7968715-B2 Phosphor dimeric metallic compound having a new co-ligand structure and an organic electroluminescence device having improved luminous efficiency and color purity; long lifespan; highly efficient phosphor host material SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-06-28 US disclosed
US-20080200678-A1 Metallic Compound and Organic Electroluminescence Device Comprising the Same SAMSUNG ELECTRONICS CO., LTD., (KR) 2008-08-21 US disclosed
WO-2007078184-A1 METALLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME INDUSTRY-UNIVERSITY COOPERATION FOUNDATION, HANYANG UNIVERSITY (KR) 2007-07-12 WO 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 (1 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-20080200678-A1 Metallic Compound and Organic Electroluminescence Device Comprising the Same RPS10, SCO2, NFE2L2 HPRT1 2726/4885HSD17B10 2563/4885ALDH1A1 971/4885

“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.