SCHEMBL3924809

SCHEMBL3924809

O=C(CCl)NC(Sc1ncccc1C(=O)Nc1ccc(C(F)(F)F)cc1)c1ccncc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.51
KMT2A Q03164 2/20 0.47
EGLN1 Q9GZT9 1/20 0.46
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
TYK2 P29597 1/20 0.45
TRPV1 Q8NER1 7/20 0.42
RXFP1 Q9HBX9 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PTGS1 P23219 1/20 0.41
SMN1; SMN2 Q16637 1/20 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
SCHEMBL3932858 0.92 RXFP1 (0.51) KDRKMT2ARXFP1MEN1ALDH1A1
SCHEMBL3932887 0.92 KMT2A (0.48) KDRKMT2ATRPV1
SCHEMBL1941872 0.92 KDR (0.52) KDRKMT2AEGLN1JAK2JAK1
SCHEMBL3935683 0.90 KDR (0.59) KDRKMT2AJAK2TYK2MEN1
SCHEMBL3926494 0.89 KDR (0.54) KDRKMT2ATRPV1MAPTHTT
SCHEMBL3928348 0.89 KDR (0.47) KDRKMT2AEGLN1JAK2JAK1
SCHEMBL1941401 0.88 KDR (0.48) KDRKMT2AEGLN1JAK2JAK1
SCHEMBL3924825 0.87 KDR (0.52) KDRKMT2AEGLN1JAK2JAK1
SCHEMBL3935235 0.86 KDR (0.45) KDRKMT2ARXFP1MEN1ALDH1A1
SCHEMBL1942036 0.86 KDR (0.45) KDRKMT2AEGLN1JAK2JAK1

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-7544703-B2 Cyclic compound having 4-pyridylalkylthio group having substituted or unsubstituted amino group introduced therein SANTEN PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 US disclosed
US-20070149574-A1 Novel cyclic compound having 4-pyridylalkylthio group having substituted or unsubstituted amino group introduced therein SANTEN PHARMACEUTICAL CO., LTD. (JP) 2007-06-28 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-20070149574-A1 Novel cyclic compound having 4-pyridylalkylthio group having substituted or unsubstituted amino group introduced therein FLT4, FLT1, TIE1 KDR 12/4885KMT2A 2966/4885EGLN1 757/4885

“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.