SCHEMBL4725435

SCHEMBL4725435

Cc1nc2c(C(=O)O)cnn2c(C)c1Cc1cc(Cl)cc(Cl)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 6/20 0.70
KDM4E B2RXH2 10/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
TSHR P16473 3/20 0.59
GAA P10253 1/20 0.59
ALDH1A1 P00352 9/20 0.58
HPGD P15428 7/20 0.58
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
LMNA P02545 9/20 0.55
TP53 P04637 7/20 0.55
MAPT P10636 6/20 0.55
HTT P42858 2/20 0.53
MAPK1 P28482 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
USP2 O75604 1/20 0.52
MEN1 O00255 1/20 0.49

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
SCHEMBL4943540 0.89 KDM4E (0.72) HSD17B10KDM4ESMN1; SMN2TSHRGAA
SCHEMBL4935332 0.88 HSD17B10 (0.82) HSD17B10KDM4ESMN1; SMN2TSHRGAA
SCHEMBL4778302 0.85 HSD17B10 (0.73) HSD17B10KDM4ESMN1; SMN2TSHRGAA
SCHEMBL4776468 0.84 HSD17B10 (0.69) HSD17B10KDM4ESMN1; SMN2TSHRGAA
SCHEMBL4781087 0.84 TP53 (0.62) HSD17B10KDM4ESMN1; SMN2TSHRALDH1A1
SCHEMBL4941774 0.84 HSD17B10 (0.83) HSD17B10KDM4ESMN1; SMN2TSHRGAA
SCHEMBL4781552 0.82 LMNA (0.61) HSD17B10KDM4ESMN1; SMN2TSHRALDH1A1
SCHEMBL4933302 0.81 HSD17B10 (0.68) HSD17B10KDM4ESMN1; SMN2TSHRGAA
SCHEMBL4779630 0.81 KDM4E (0.63) HSD17B10KDM4ESMN1; SMN2TSHRGAA
SCHEMBL4782331 0.81 HSD17B10 (0.74) HSD17B10KDM4ESMN1; SMN2TSHRGAA

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 3813/4885SMN1; SMN2 2914/4885

“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.