SCHEMBL709830

SCHEMBL709830

Nc1ccc(-c2ccccc2)c(-c2nccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 1/20 0.43
AURKA O14965 1/20 0.43
HSP90AA1 P07900 1/20 0.43
PRKACA P17612 1/20 0.43
ADORA2A P29274 1/20 0.43
MAPT P10636 7/20 0.42
KMT2A Q03164 6/20 0.42
MEN1 O00255 5/20 0.42
ALDH1A1 P00352 4/20 0.42
HPGD P15428 3/20 0.42
KDM4E B2RXH2 5/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 2/20 0.41
GLA P06280 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
SCHEMBL710851 0.82 AURKA (0.44) ASIC3AURKAHSP90AA1PRKACAADORA2A
SCHEMBL2574125 0.81 ALDH1A1 (0.59) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL973065 0.79 ALDH1A1 (0.61) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL28036730 0.78 ALDH1A1 (0.64) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL30128689 0.78 ALDH1A1 (0.64) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL712182 0.77 HSP90AA1 (0.69) AURKAHSP90AA1PRKACAADORA2AMAPT
SCHEMBL710947 0.77 S1PR1 (0.39) AURKAHSP90AA1PRKACAADORA2AMAPT
SCHEMBL8666169 0.76 ALDH1A1 (0.53) HSP90AA1MAPTKMT2AMEN1ALDH1A1
SCHEMBL28836453 0.75 ALDH1A1 (0.60) HSP90AA1MAPTKMT2AMEN1ALDH1A1
SCHEMBL15449462 0.73 ALDH1A1 (0.62) MAPTKMT2AMEN1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124762-B2 Diphenyl amine derivatives having luminescence property KOREA INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2012-02-28 US disclosed
US-20100063281-A1 DIPHENYL AMINE DERIVATIVES HAVING LUMINESCENCE PROPERTY KOREA INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 2010-03-11 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-20100063281-A1 DIPHENYL AMINE DERIVATIVES HAVING LUMINESCENCE PROPERTY TYR, PNMT, DDC ASIC3 3388/4885AURKA 235/4885HSP90AA1 4693/4885

“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.