SCHEMBL14289404

SCHEMBL14289404

Cc1cccc(/C=N/NC(=O)OC(C)(C)C)c1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.67
MAPT P10636 7/20 0.67
SMN1; SMN2 Q16637 6/20 0.67
NPC1 O15118 5/20 0.67
KDM4E B2RXH2 3/20 0.62
MIF P14174 1/20 0.62
RECQL P46063 1/20 0.60
LMNA P02545 4/20 0.52
GAA P10253 1/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.51
TDP1 Q9NUW8 2/20 0.51
KMT2A Q03164 4/20 0.51
ALDH1A1 P00352 1/20 0.51
MEN1 O00255 2/20 0.49
MAPK1 P28482 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
SCHEMBL23241901 0.91 MAPT (0.74) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL23241902 0.91 MAPT (0.74) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL6423387 0.84 MAPT (0.76) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL3266677 0.84 MAPT (0.76) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL12979794 0.84 MAPT (0.76) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL5767618 0.84 MAPT (0.71) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL1573369 0.84 KDM4E (0.67) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL1573371 0.84 KDM4E (0.67) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL13401232 0.82 MIF (0.78) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL13903541 0.82 MIF (0.68) RAB9AMAPTSMN1; SMN2NPC1KDM4E

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-20080004256-A1 Amidinophenylalanine Derivatives as Thrombin Inhibitors LEK PHARMACEUTICALS D.D. (SI) 2008-01-03 US disclosed
US-7285547-B2 Amidinophenylalanine derivatives as thrombin inhibitors LEK PHARMACEUTICALS D.D. (SI) 2007-10-23 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 (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-20080004256-A1 Amidinophenylalanine Derivatives as Thrombin Inhibitors TFPI, SERPINC1, F2 RAB9A 1859/4885MAPT 2136/4885SMN1; SMN2 2698/4885

“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.