SCHEMBL13023404

SCHEMBL13023404

Cc1ccc(N2c3ccccc3C=Cc3ccccc32)c(-c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.41
HDAC7 Q8WUI4 1/20 0.39
PSMB5 P28074 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
PIM1 P11309 1/20 0.36
HPRT1 P00492 1/20 0.36
ALDH1A1 P00352 3/20 0.35
MAOB P27338 1/20 0.35
KDM4E B2RXH2 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
HPGD P15428 1/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
NCOA1 Q15788 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34

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
SCHEMBL13022555 0.91 MGLL (0.46) MGLLHDAC7PSMB5HPRT1ALDH1A1
SCHEMBL13021769 0.87 MGLL (0.49) MGLLHDAC7PSMB5PTGDR2ALDH1A1
SCHEMBL13023776 0.85 MGLL (0.33) MGLLHDAC7PSMB5PTGDR2PIM1
SCHEMBL13023921 0.80 MAOB (0.34) ALDH1A1MAOBKDM4EHPGDMEN1
SCHEMBL13023576 0.80 ALDH1A1 (0.38) HDAC7PSMB5PTGDR2ALDH1A1KDM4E
SCHEMBL13023372 0.80 NPSR1 (0.41) MGLLALDH1A1KDM4ENPSR1HPGD
SCHEMBL13023349 0.79 MAOA (0.42) MGLLHDAC7PSMB5PTGDR2ALDH1A1
SCHEMBL13023402 0.79 SMN1; SMN2 (0.41) MGLLHDAC7PSMB5PTGDR2ALDH1A1
SCHEMBL13023385 0.79 PSMB5 (0.40) MGLLHDAC7PSMB5PTGDR2ALDH1A1
SCHEMBL13023302 0.79 P2RX4 (0.41) MGLLHDAC7PSMB5PTGDR2ALDH1A1

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-20100286360-A1 POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-11 US disclosed
US-20100286360-A1 POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-11 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-20100286360-A1 POLYMER COMPOUND AND POLYMER LIGHT EMITTING DEVICE USING THE SAME IGF1R, SCO2, CRY1 MGLL 1758/4885HDAC7 2509/4885PSMB5 1233/4885

“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.