SCHEMBL1855879

SCHEMBL1855879

O=C(c1ccc2[nH]cnc2c1)N1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 12/20 0.61
ALDH1A1 P00352 3/20 0.56
GRIA3 P42263 1/20 0.56
GRIA4 P48058 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.53
KDM4E B2RXH2 2/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
GFER P55789 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
HSD11B1 P28845 1/20 0.51
TDP1 Q9NUW8 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
SCHEMBL1855882 1.00 HPGD (0.61) HPGDALDH1A1GRIA3GRIA4SMN1; SMN2
SCHEMBL29565081 1.00 HPGD (0.61) HPGDALDH1A1GRIA3GRIA4SMN1; SMN2
SCHEMBL13373550 0.99 HPGD (0.58) HPGDALDH1A1GRIA3GRIA4SMN1; SMN2
SCHEMBL5805385 0.89 ALDH1A1 (0.70) HPGDALDH1A1GRIA3GRIA4SMN1; SMN2
SCHEMBL14559795 0.87 SMN1; SMN2 (0.52) HPGDALDH1A1SMN1; SMN2KDM4EPOLB
SCHEMBL12431600 0.87 ALDH1A1 (0.71) HPGDALDH1A1GRIA3GRIA4SMN1; SMN2
SCHEMBL22999769 0.86 KDM4E (0.55) HPGDALDH1A1SMN1; SMN2KDM4EPOLB
SCHEMBL111568 0.86 ALDH1A1 (0.54) HPGDALDH1A1SMN1; SMN2KDM4EPOLB
SCHEMBL13646643 0.86 SMN1; SMN2 (0.60) HPGDALDH1A1SMN1; SMN2KDM4EPOLB
SCHEMBL3153203 0.86 SMN1; SMN2 (0.57) HPGDALDH1A1SMN1; SMN2KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097419-B1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS INC (US) 2011-05-25 EP disclosed
US-20090247559-A1 Benzofuropyrimidinones EXELIXIS, INC. (US) 2009-10-01 US disclosed
WO-2009086264-A1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS, INC. (US) 2009-07-09 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-20090247559-A1 Benzofuropyrimidinones F12, BRI3BP, BRD1 HPGD 2284/4885ALDH1A1 315/4885GRIA3 2649/4885

“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.