SCHEMBL5957030

SCHEMBL5957030

Brc1ccc(N(c2cccc3ccccc23)c2cc3ccccc3c3ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 3/20 0.36
HIF1A Q16665 1/20 0.36
CYP1B1 Q16678 1/20 0.36
SIGMAR1 Q99720 8/20 0.36
HPRT1 P00492 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TRPM4 Q8TD43 1/20 0.33
CYP1A2 P05177 2/20 0.33
HPGD P15428 1/20 0.33
CYP2A6 P11509 2/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL5957022 0.92 TRPM4 (0.38) ALDH1A1HSD17B10HIF1ACYP1B1HPRT1
SCHEMBL127264 0.91 MEN1 (0.37) ALDH1A1HSD17B10HIF1ACYP1B1HPRT1
SCHEMBL30636158 0.89 SIGMAR1 (0.43) ALDH1A1HSD17B10SIGMAR1KMT2ACYP1A2
SCHEMBL5956974 0.89 SIGMAR1 (0.43) ALDH1A1HSD17B10SIGMAR1KMT2ACYP1A2
SCHEMBL21188054 0.88 ALDH1A1 (0.38) ALDH1A1HSD17B10HIF1ACYP1B1SIGMAR1
SCHEMBL22669853 0.87 SIGMAR1 (0.43) ALDH1A1HSD17B10HIF1ACYP1B1SIGMAR1
SCHEMBL18069083 0.86 ALDH1A1 (0.37) ALDH1A1HSD17B10HIF1ACYP1B1SIGMAR1
SCHEMBL18069074 0.86 ALDH1A1 (0.37) ALDH1A1HSD17B10HIF1ACYP1B1SIGMAR1
SCHEMBL18069086 0.86 ALDH1A1 (0.37) ALDH1A1HSD17B10HIF1ACYP1B1SIGMAR1
SCHEMBL5956958 0.86 MEN1 (0.40) ALDH1A1HSD17B10HIF1ACYP1B1HPRT1

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-20060061265-A1 Aromatic amine derivative and organic electroluminescent element employing the same IDEMITSU KOSAN CO., LTD. (JP) 2006-03-23 US disclosed
EP-1559706-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2005-08-03 EP 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-20060061265-A1 Aromatic amine derivative and organic electroluminescent element employing the same LUC7L2, ARL1, ASH2L ALDH1A1 770/4885HSD17B10 1892/4885HIF1A 2374/4885

“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.