SCHEMBL868405

SCHEMBL868405

Cc1ccc(C(=O)Nc2ccc(-c3cncc(C(=O)N=[S@@](C)(=O)c4ccccc4)c3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
KDR P35968 2/20 0.46
PDGFRB P09619 1/20 0.46
MAPT P10636 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SCN10A Q9Y5Y9 3/20 0.46
FABP1 P07148 1/20 0.46
P2RY14 Q15391 1/20 0.46
CHRNA7 P36544 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NAMPT P43490 2/20 0.45
PSMD14 O00487 1/20 0.45
POLB P06746 1/20 0.45
RECQL P46063 1/20 0.45
CACNA1B Q00975 1/20 0.45
APBA1 Q02410 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
SAE1 Q9UBE0 1/20 0.45

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
SCHEMBL10183172 0.87 SMO (0.48) SMN1; SMN2KDRPDGFRBMAPTNPC1
SCHEMBL834671 0.86 KDR (0.60) SMN1; SMN2KDRPDGFRBMAPTNPC1
SCHEMBL834670 0.86 KDR (0.60) SMN1; SMN2KDRPDGFRBMAPTNPC1
SCHEMBL871109 0.84 MEN1 (0.47) SMN1; SMN2MAPTNPC1RAB9AMEN1
SCHEMBL10182660 0.83 KAT6A (0.54) KDRPDGFRBSCN10AKAT6AEGFR
SCHEMBL834924 0.77 KDR (0.50) KDRPDGFRBMAPTNPC1RAB9A
SCHEMBL834925 0.77 KDR (0.50) KDRPDGFRBMAPTNPC1RAB9A
SCHEMBL12262710 0.76 PIK3CA (0.42) KDRPDGFRBKAT6A
SCHEMBL11985206 0.76 PIK3CA (0.42) KDRPDGFRBKAT6A
SCHEMBL10182212 0.75 NAMPT (0.45) SMN1; SMN2KDRPDGFRBMAPTNPC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383825-B2 Kinase inhibitors ALLERGAN, INC. (US) 2013-02-26 US disclosed
US-8143410-B2 Kinase inhibitors ALLERGAN, INC. (US) 2012-03-27 US disclosed
US-20110263611-A1 Kinase Inhibitors ALLERGAN, INC. 2011-10-27 US disclosed
US-20090196906-A1 Kinase inhibitors ALLERGAN, INC. 2009-08-06 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 (2 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-20110263611-A1 Kinase Inhibitors PTK2, MAP3K6, MAP3K20 SMN1; SMN2 4781/4885KDR 51/4885PDGFRB 368/4885
US-20090196906-A1 Kinase inhibitors PTK2, MAP3K6, MAP3K20 SMN1; SMN2 4781/4885KDR 51/4885PDGFRB 368/4885

“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.