SCHEMBL6497799

SCHEMBL6497799

[CH2]NC(=O)c1ccccc1C

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.60
SMN1; SMN2 Q16637 4/20 0.55
POLB P06746 1/20 0.53
TYK2 P29597 1/20 0.53
NPC1 O15118 5/20 0.51
RAB9A P51151 5/20 0.51
ALDH1A1 P00352 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GAA P10253 3/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
DHODH Q02127 1/20 0.49
KCNK3 O14649 1/20 0.49
KCNK9 Q9NPC2 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
SCHEMBL2650229 0.82 POLB (0.72) HPGDSMN1; SMN2POLBTYK2NPC1
SCHEMBL3140037 0.82 HPGD (0.64) HPGDSMN1; SMN2POLBTYK2NPC1
SCHEMBL1276162 0.80 HPGD (0.62) HPGDSMN1; SMN2POLBTYK2NPC1
SCHEMBL29746319 0.80 HPGD (0.62) HPGDSMN1; SMN2POLBTYK2NPC1
SCHEMBL8773443 0.80 HPGD (0.62) HPGDSMN1; SMN2POLBTYK2NPC1
SCHEMBL311564 0.80 HPGD (0.62) HPGDSMN1; SMN2POLBTYK2NPC1
SCHEMBL4815209 0.80 HPGD (0.62) HPGDSMN1; SMN2POLBTYK2NPC1
SCHEMBL1128274 0.78 HPGD (0.60) HPGDSMN1; SMN2POLBTYK2NPC1
SCHEMBL4914462 0.78 HPGD (0.60) HPGDSMN1; SMN2POLBTYK2NPC1
SCHEMBL3924293 0.78 HPGD (0.60) HPGDSMN1; SMN2POLBTYK2NPC1

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
WO-2005016883-A2 ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF ICOS CORPORATION (US) 2005-02-24 WO claimed
US-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. 2005-06-30 US disclosed
WO-2005016883-A2 ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF ICOS CORPORATION (US) 2005-02-24 WO disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP 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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor CCR8, CCL11, CCR5 HPGD 761/4885SMN1; SMN2 4743/4885POLB 3458/4885

“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.