SCHEMBL14033191

SCHEMBL14033191

CCOC(=O)c1cnn2cc(Cc3ccccc3)c(C)nc12

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 4/20 0.48
HPGD P15428 4/20 0.48
RAB9A P51151 3/20 0.48
HSD17B10 Q99714 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 2/20 0.48
APAF1 O14727 1/20 0.48
MAP2K1 Q02750 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
CCNA2 P20248 1/20 0.46
CDK2 P24941 1/20 0.46
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
PDE3B Q13370 2/20 0.44
PDE3A Q14432 2/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL4436848 0.88 HSD17B10 (0.48) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL14033637 0.79 TGFBR1 (0.42) ALDH1A1KDM4EHPGDRAB9AHSD17B10
SCHEMBL17781294 0.79 KDM4E (0.49) ALDH1A1KDM4EHPGDRAB9AHSD17B10
SCHEMBL29220730 0.77 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDRAB9AHSD17B10
SCHEMBL14033028 0.76 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDRAB9AHSD17B10
SCHEMBL14033899 0.76 NPC1 (0.58) ALDH1A1KDM4EHPGDRAB9AHSD17B10
SCHEMBL14033711 0.76 CCNA2 (0.56) ALDH1A1KDM4EHPGDRAB9AHSD17B10
SCHEMBL29220714 0.75 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDRAB9AHSD17B10
SCHEMBL30184311 0.74 ALDH1A1 (0.59) ALDH1A1KDM4EHPGDRAB9AHSD17B10
SCHEMBL25310219 0.72 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDRAB9AHSD17B10

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
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 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-20080255153-A1 New compounds SCD, SCD5, FADS2 ALDH1A1 1498/4885KDM4E 1192/4885HPGD 364/4885

“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.