SCHEMBL2923115

SCHEMBL2923115

CCCCn1c(-c2cccs2)nc2sc3c(c2c1=O)CCCC3=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ HPGD P15428 5/20 0.48
▸ MAPT P10636 4/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ KDM4E B2RXH2 4/20 0.48
▸ HSD17B10 Q99714 4/20 0.48
▸ CASP1 P29466 3/20 0.48
▸ TP53 P04637 3/20 0.48
▸ LMNA P02545 3/20 0.48
▸ TSHR P16473 3/20 0.48
▸ CASP7 P55210 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ HCRTR1 O43613 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ PDE4D Q08499 2/20 0.42

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
SCHEMBL2918071 0.89 ALDH1A1 (0.51) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL13869753 0.86 SMN1; SMN2 (0.66) ALDH1A1RXFP1HPGDMAPTRAB9A
SCHEMBL2926159 0.83 ALDH1A1 (0.49) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL3021395 0.82 ALDH1A1 (0.44) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL2924151 0.77 CDKN1A (0.43) ALDH1A1RXFP1HPGDMAPTSMN1; SMN2
SCHEMBL2920118 0.74 SMN1; SMN2 (0.66) ALDH1A1RXFP1HPGDMAPTRAB9A
SCHEMBL2920448 0.72 ALDH1A1 (0.48) ALDH1A1RXFP1HPGDMAPTRAB9A
SCHEMBL2944116 0.72 ALDH1A1 (0.52) ALDH1A1HPGDMAPTSMN1; SMN2KDM4E
SCHEMBL13176213 0.70 MAPT (0.49) ALDH1A1HPGDMAPTRAB9ASMN1; SMN2
SCHEMBL2925985 0.70 MAPT (0.49) ALDH1A1HPGDMAPTKDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1635839-B1 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY ABBOTT HEALTHCARE PRODUCTS BV (NL) 2010-09-01 — — EP disclosed
EP-1635839-B1 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY ABBOTT HEALTHCARE PRODUCTS BV (NL) 2010-09-01 — — EP disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 — — US disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 — — US disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 — — US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 — — US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 — — US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 — — US disclosed
EP-1635839-A2 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY Solvay Pharmaceuticals B.V. (NL) 2006-03-22 — — EP disclosed
US-20050176742-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-08-11 — — US disclosed
WO-2005032527-A2 BENZO (4, 5) THIENO (2, 3-D) PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY SOLVAY PHARMACEUTICALS B.V. (NL) 2005-04-14 — — WO disclosed
US-20050038053-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-02-17 — — 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 (2 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-20050176742-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 ALDH1A1 229/4885RXFP1 4127/4885HPGD 96/4885
US-20050038053-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 ALDH1A1 229/4885RXFP1 4127/4885HPGD 96/4885

“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.

Send feedback