SCHEMBL15316784

SCHEMBL15316784

COCCn1c(=O)c2c(N)c3c(=O)c4ccccc4c(=O)c3c(N)c2c1=O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
TSHR P16473 1/20 0.51
HPGD P15428 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
S100A4 P26447 1/20 0.45
HSD17B10 Q99714 1/20 0.43
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
PKM P14618 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
SCHEMBL5007718 0.92 ALDH1A1 (0.64) ALDH1A1TSHRHPGDRXFP1MEN1
SCHEMBL29396554 0.92 ALDH1A1 (0.64) ALDH1A1TSHRHPGDRXFP1MEN1
SCHEMBL10067790 0.90 ALDH1A1 (0.58) ALDH1A1TSHRHPGDRXFP1MEN1
SCHEMBL10703149 0.87 ALDH1A1 (0.55) ALDH1A1TSHRHPGDRXFP1MEN1
SCHEMBL12269537 0.87 S100A4 (0.46) ALDH1A1TSHRHPGDRXFP1MEN1
SCHEMBL5007745 0.83 ALDH1A1 (0.53) ALDH1A1TSHRHPGDRXFP1MEN1
SCHEMBL30365979 0.83 ALDH1A1 (0.53) ALDH1A1TSHRHPGDRXFP1MEN1
SCHEMBL29363109 0.83 ALDH1A1 (0.53) ALDH1A1TSHRHPGDRXFP1MEN1
SCHEMBL10057893 0.83 S100A4 (0.51) ALDH1A1HPGDMEN1KMT2ACYP1A2
SCHEMBL14950589 0.82 ALDH1A1 (0.49) ALDH1A1TSHRHPGDRXFP1MEN1

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-8579993-B2 Use of dyestuffs for dyeing keratin fibers and compositions comprising the dyestuffs KAO GERMANY GMBH (DE) 2013-11-12 US disclosed
US-20130269121-A1 USE OF DYESTUFFS FOR DYEING KERATIN FIBERS AND COMPOSITIONS COMPRISING THE DYESTUFFS KAO GERMANY GMBH (DE) 2013-10-17 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-20130269121-A1 USE OF DYESTUFFS FOR DYEING KERATIN FIBERS AND COMPOSITIONS COMPRISING THE DYESTUFFS KRT18, DOHH, CHCHD3 ALDH1A1 639/4885TSHR 3740/4885HPGD 385/4885

“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.