SCHEMBL5429435

SCHEMBL5429435

c1ccc(Nc2c3ccccc3c(-c3c4ccccc4c(Nc4ccccc4)c4ccccc34)c3ccccc23)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 7/20 0.61
HSD17B10 Q99714 3/20 0.52
KMT2A Q03164 5/20 0.50
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 3/20 0.50
ALOX15 P16050 3/20 0.50
TSHR P16473 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
MAPT P10636 2/20 0.50
GAA P10253 2/20 0.50
KDM4E B2RXH2 1/20 0.50
GLA P06280 1/20 0.50
RECQL P46063 1/20 0.50
ALOX12 P18054 1/20 0.50
PTGS1 P23219 1/20 0.50
SLC6A2 P23975 1/20 0.50
MAPK1 P28482 1/20 0.50
PTGS2 P35354 1/20 0.50
HTR2B P41595 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL29601561 0.92 KDM1A (0.70) KDM1AHSD17B10KMT2AALDH1A1MEN1
SCHEMBL1922099 0.92 KDM1A (0.70) KDM1AHSD17B10KMT2AALDH1A1MEN1
SCHEMBL7601536 0.84 KDM1A (0.60) KDM1AHSD17B10KMT2AALDH1A1MEN1
SCHEMBL22954302 0.82 KDM1A (0.48) KDM1AHSD17B10KMT2AALDH1A1MEN1
SCHEMBL12571895 0.78 ALDH1A1 (0.50) KDM1AHSD17B10KMT2AALDH1A1MEN1
SCHEMBL3287371 0.76 KDM1A (0.63) KDM1AHSD17B10KMT2AALDH1A1MEN1
SCHEMBL902770 0.76 KDM1A (1.00) KDM1AKMT2AMEN1TDP1MAPT
Triphenylene SCHEMBL28455104 0.75 HSD17B10 (0.80) KDM1AHSD17B10KMT2AALDH1A1MEN1
SCHEMBL19534244 0.75 GAA (0.54) KDM1AHSD17B10KMT2AALDH1A1MEN1
Hydrochloric Acid SCHEMBL15673452 0.75 KDM1A (0.96) KDM1AKMT2AMEN1TDP1MAPT

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-20070152568-A1 Compounds for an organic electroluminescent device and an organic electroluminescent device using the same LABELTEK INC. (TW) 2007-07-05 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-20070152568-A1 Compounds for an organic electroluminescent device and an organic electroluminescent device using the same C1S, MAL2, C5 KDM1A 1669/4885HSD17B10 2582/4885KMT2A 2236/4885

“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.