SCHEMBL5493498

SCHEMBL5493498

c1ccc(Nc2ccc(-c3ccc(Nc4ccc(-c5ccccc5)cc4)c(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)c3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 2/20 0.40
ALDH1A1 P00352 8/20 0.38
HSD17B10 Q99714 5/20 0.38
TDP1 Q9NUW8 4/20 0.38
ALOX15 P16050 3/20 0.38
MAPK1 P28482 3/20 0.38
TSHR P16473 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALOX12 P18054 1/20 0.38
PTGS1 P23219 1/20 0.38
SLC6A2 P23975 1/20 0.38
PTGS2 P35354 1/20 0.38
HTR2B P41595 1/20 0.38
MAPKAPK2 P49137 2/20 0.37
PTGER4 P35408 1/20 0.36
MAPT P10636 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
AR P10275 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35

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
SCHEMBL2210750 0.98 ALDH1A1 (0.39) ALKALDH1A1HSD17B10TDP1ALOX15
SCHEMBL2213679 0.97 ALK (0.42) ALKALDH1A1HSD17B10TDP1ALOX15
SCHEMBL4611855 0.97 ALK (0.42) ALKALDH1A1HSD17B10TDP1ALOX15
SCHEMBL4806069 0.91 ALDH1A1 (0.41) ALKALDH1A1HSD17B10TDP1ALOX15
SCHEMBL13260855 0.89 HPGD (0.42) TDP1L3MBTL1MAPKAPK2PTGER4MAPT
SCHEMBL17661359 0.87 ALK (0.49) ALKALDH1A1HSD17B10TDP1ALOX15
SCHEMBL21185707 0.86 CA12 (0.41) ALKALDH1A1HSD17B10ALOX15TSHR
SCHEMBL20484337 0.86 ALK (0.46) ALKALDH1A1HSD17B10TDP1ALOX15
SCHEMBL30406285 0.86 ALK (0.46) ALKALDH1A1HSD17B10TDP1ALOX15
SCHEMBL22435802 0.86 ALK (0.46) ALKALDH1A1HSD17B10TDP1ALOX15

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-20070179318-A1 Aromatic amine derivative and organic electroluminescence device using same IDEMITSU KOSAN CO., LTD. (JP) 2007-08-02 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-20070179318-A1 Aromatic amine derivative and organic electroluminescence device using same TYR, KCNN2, MAOA ALK 328/4885ALDH1A1 266/4885HSD17B10 2373/4885

“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.