SCHEMBL14033397

SCHEMBL14033397

CCOC(=O)c1cnn2c(C)c(Cc3ccc(Cl)c(OC(F)(F)F)c3)cnc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.47
RAB9A P51151 5/20 0.47
KDM4E B2RXH2 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
BRAF P15056 4/20 0.43
ALDH1A1 P00352 5/20 0.43
MAPT P10636 3/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA5A P35218 2/20 0.42
CA9 Q16790 2/20 0.42
KDM4A O75164 1/20 0.41
KDM5A P29375 1/20 0.41
HPGD P15428 3/20 0.41

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
SCHEMBL14033210 0.91 KDM4A (0.50) NPC1RAB9AKDM4ESMN1; SMN2LMNA
SCHEMBL14033412 0.90 KDM4E (0.45) NPC1RAB9AKDM4ESMN1; SMN2LMNA
SCHEMBL14033393 0.84 BRAF (0.53) NPC1RAB9AKDM4ESMN1; SMN2LMNA
SCHEMBL14033911 0.84 PDE2A (0.43) KDM4ESMN1; SMN2LMNAPOLBBRAF
SCHEMBL14033045 0.81 PDE2A (0.41) KDM4ELMNAPOLBBRAFALDH1A1
SCHEMBL14033052 0.81 KDM4E (0.42) KDM4ESMN1; SMN2ALDH1A1KDM4AKDM5A
SCHEMBL4439055 0.80 BRAF (0.54) NPC1RAB9AKDM4ESMN1; SMN2BRAF
SCHEMBL14033899 0.77 NPC1 (0.58) NPC1RAB9AKDM4ESMN1; SMN2LMNA
SCHEMBL14033041 0.76 KDM5A (0.46) KDM4ESMN1; SMN2BRAFALDH1A1KDM5A
SCHEMBL14033910 0.74 RIPK1 (0.44) KDM4ESMN1; SMN2LMNAPOLBALDH1A1

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 NPC1 221/4885RAB9A 3147/4885KDM4E 1192/4885

“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.