SCHEMBL2817231

SCHEMBL2817231

Brc1c2ccccc2c(Nc2ncccc2-c2ccccc2)c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 5/20 0.38
DHODH Q02127 2/20 0.38
USP30 Q70CQ3 1/20 0.38
GLO1 Q04760 2/20 0.35
CKS1B P61024 2/20 0.35
SKP2 Q13309 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
KDR P35968 3/20 0.33
DYRK1A Q13627 3/20 0.33
JAK2 O60674 2/20 0.33
PRKD3 O94806 2/20 0.33
MAP4K4 O95819 2/20 0.33
IGF1R P08069 2/20 0.33
FGFR1 P11362 2/20 0.33
FLT1 P17948 2/20 0.33
MAPK8 P45983 2/20 0.33
CLK2 P49760 2/20 0.33
JAK3 P52333 2/20 0.33
CDK5 Q00535 2/20 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
SCHEMBL2817686 0.80 TNF (0.40) ABCG2DHODHUSP30ALDH1A1MAPK1
SCHEMBL2789429 0.76 ABCG2 (0.50) ABCG2DHODHALDH1A1MAPK1
SCHEMBL15401372 0.74 FABP3 (0.46) USP30ALDH1A1KDRAURKAIRAK4
SCHEMBL17612628 0.70 KDM4E (0.44) USP30GLO1CKS1BSKP2ALDH1A1
SCHEMBL27016369 0.69 ALDH1A1 (0.46) DHODHALDH1A1KDRMAP4K4FGFR1
SCHEMBL1821476 0.68 DHODH (0.50) ABCG2DHODHALDH1A1MAPK1KDR
SCHEMBL1203598 0.67 ALDH1A1 (0.50) ALDH1A1MAPK1MAP4K4
SCHEMBL28530013 0.66 KMT2A (0.50) DHODHALDH1A1MKNK2
SCHEMBL27650403 0.66 TOP1 (0.41) DHODHUSP30GLO1CKS1BSKP2
SCHEMBL12626750 0.65 ALDH1A1 (0.48) ALDH1A1MAPK1KDRMAP4K4FGFR1

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
US-20100164371-A1 ELECTRON TRANSPORTING-INJECTION COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME LG. DISPLAY CO. LTD. (KR) 2010-07-01 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 (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-20100164371-A1 ELECTRON TRANSPORTING-INJECTION COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME SLCO4C1, SLCO2A1, SLCO2B1 ABCG2 364/4885DHODH 1912/4885USP30 4277/4885

“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.