SCHEMBL430718

SCHEMBL430718

C=CCc1cccc2c1ccc1nnc(C)n12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
PBRM1 Q86U86 1/20 0.48
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
BRD4 O60885 11/20 0.41
PKM P14618 4/20 0.39
MAPT P10636 3/20 0.37
NPSR1 Q6W5P4 3/20 0.37
HTT P42858 2/20 0.37
USP2 O75604 2/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
HIF1A Q16665 1/20 0.37
TP53 P04637 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
POLB P06746 1/20 0.36
ALOX15 P16050 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL428348 0.86 SMN1; SMN2 (0.48) L3MBTL1SMN1; SMN2PBRM1BRD4
SCHEMBL429354 0.76 GABRA1 (0.38) L3MBTL1SMN1; SMN2MEN1KMT2APKM
SCHEMBL430483 0.75 SMN1; SMN2 (0.44) L3MBTL1SMN1; SMN2PBRM1BRD4
SCHEMBL426973 0.74 SMN1; SMN2 (0.43) L3MBTL1SMN1; SMN2PBRM1BRD4
SCHEMBL426941 0.69 KDM4E (0.43) MEN1KMT2AALDH1A1LMNA
SCHEMBL428070 0.65 KDM4E (0.41) L3MBTL1SMN1; SMN2MEN1KMT2APKM
SCHEMBL5831594 0.65 GABRA1 (0.56) L3MBTL1MEN1KMT2APKMMAPT
SCHEMBL31619949 0.65 GABRA1 (0.56) L3MBTL1MEN1KMT2APKMMAPT
SCHEMBL22355711 0.63 GABRA1 (0.54) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL429522 0.62 HPGD (0.33) ALDH1A1

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-20120022056-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS BENTLEY JONATHAN (IT) 2012-01-26 US disclosed
US-20120022056-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS BENTLEY JONATHAN (IT) 2012-01-26 US disclosed
EP-1786822-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS GLAXO GROUP LIMITED (GB) 2007-05-23 EP disclosed
WO-2006024517-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS GLAXO GROUP LIMITED (GB) 2006-03-09 WO 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-20120022056-A1 FUSED TRICYCLIC DERIVATIVES FOR THE TREATMENT OF PSYCHOTIC DISORDERS GABBR1, GABRQ, GABRE L3MBTL1 698/4885SMN1; SMN2 3271/4885PBRM1 1014/4885

“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.