SCHEMBL4782331

SCHEMBL4782331

Cc1cccc(Cc2c(C)nc3c(C(=O)O)cnn3c2C)c1

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 7/20 0.74
KDM4E B2RXH2 12/20 0.67
ALDH1A1 P00352 10/20 0.67
HPGD P15428 8/20 0.67
LMNA P02545 8/20 0.67
MAPT P10636 6/20 0.67
TP53 P04637 5/20 0.67
SMN1; SMN2 Q16637 4/20 0.67
TSHR P16473 4/20 0.67
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
HTT P42858 3/20 0.67
NPSR1 Q6W5P4 2/20 0.67
USP2 O75604 2/20 0.67
ALOX12 P18054 1/20 0.67
MAPK1 P28482 2/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
GAA P10253 1/20 0.57
RUVBL1 Q9Y265 1/20 0.51

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
SCHEMBL4941774 0.89 HSD17B10 (0.83) HSD17B10KDM4EALDH1A1HPGDLMNA
SCHEMBL4941861 0.89 KDM4E (0.81) HSD17B10KDM4EALDH1A1HPGDLMNA
SCHEMBL4943540 0.89 KDM4E (0.72) HSD17B10KDM4EALDH1A1HPGDLMNA
SCHEMBL4933302 0.89 HSD17B10 (0.68) HSD17B10KDM4EALDH1A1HPGDLMNA
SCHEMBL4941534 0.87 KDM4E (0.66) HSD17B10KDM4EALDH1A1HPGDLMNA
SCHEMBL4776338 0.86 HSD17B10 (0.64) HSD17B10KDM4EALDH1A1HPGDLMNA
SCHEMBL4782056 0.85 HSD17B10 (0.73) HSD17B10KDM4EALDH1A1HPGDLMNA
SCHEMBL4780599 0.85 LMNA (0.70) HSD17B10KDM4EALDH1A1HPGDLMNA
SCHEMBL4778096 0.84 HSD17B10 (0.62) HSD17B10KDM4EALDH1A1HPGDLMNA
SCHEMBL4781547 0.83 KDM4E (0.64) HSD17B10KDM4EALDH1A1HPGDLMNA

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-20080221129-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-09-11 US disclosed
WO-2008003753-A1 PYRAZOLO [1,5-A] PYRIMIDINE ANALOGS FOR USE AS INHIBITORS OF STEAROYL-COA DESATURASE (SCD) ACTIVITY BIOVITRUM AB (PUBL) (SE) 2008-01-10 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-20080221129-A1 New compounds SCD, SCD5, FASN HSD17B10 47/4885KDM4E 3813/4885ALDH1A1 858/4885

“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.