SCHEMBL12579263

SCHEMBL12579263

c1ccc(-c2ccc(-c3cc(-c4c5ccccc5cc5ccccc45)nc(-c4ccc(-c5ccccn5)cc4)n3)cc2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.48
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HPGD P15428 2/20 0.42
MAPT P10636 2/20 0.42
NTSR1 P30989 1/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPK1 P28482 1/20 0.42
KDM4E B2RXH2 4/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
METAP1 P53582 2/20 0.41
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
KLF5 Q13887 1/20 0.40

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
SCHEMBL10051240 0.98 DHODH (0.47) DHODHALDH1A1MEN1KMT2AHPGD
SCHEMBL10051341 0.89 DHODH (0.49) DHODHALDH1A1HPGDMAPTTSHR
SCHEMBL973168 0.88 ADORA3 (0.49) ALDH1A1MEN1KMT2AHPGDTSHR
SCHEMBL12579478 0.88 DHODH (0.39) DHODHALDH1A1MEN1KMT2AHPGD
SCHEMBL12579273 0.87 DHODH (0.50) DHODHALDH1A1MEN1KMT2AHPGD
SCHEMBL12579271 0.86 MAPT (0.49) DHODHALDH1A1MEN1KMT2AHPGD
SCHEMBL15835177 0.85 DHODH (0.50) DHODHALDH1A1MEN1KMT2AHPGD
SCHEMBL10051241 0.85 DHODH (0.49) DHODHALDH1A1MEN1KMT2AHPGD
SCHEMBL17944934 0.85 KDM4E (0.56) DHODHALDH1A1MEN1KMT2AHPGD
SCHEMBL12579270 0.85 ALDH1A1 (0.48) DHODHALDH1A1MEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8470454-B2 Material for organic photoelectric device and organic photoelectric device including the same CHEIL INDUSTRIES, INC. (KR) 2013-06-25 US disclosed
US-8470454-B2 Material for organic photoelectric device and organic photoelectric device including the same CHEIL INDUSTRIES, INC. (KR) 2013-06-25 US disclosed
US-20110156014-A1 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME CHEIL INDUSTRIES, INC. (KR) 2011-06-30 US disclosed
US-20110156014-A1 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME CHEIL INDUSTRIES, INC. (KR) 2011-06-30 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-20110156014-A1 MATERIAL FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME AXIN2, CTNNA1, CCNA1 DHODH 4138/4885ALDH1A1 295/4885MEN1 495/4885

“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.