SCHEMBL1640427

SCHEMBL1640427

Cn1cccc1C(=O)Nc1cccc(C(=O)Cc2ccnc(Cl)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
GRM1 Q13255 1/20 0.42
HPGD P15428 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
POLB P06746 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TSHR P16473 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL3422489 0.81 NPC1 (0.42) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL1640536 0.80 KCNQ3 (0.45) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL13121040 0.79 MAPT (0.49) HDAC1HDAC6GRM1HPGDSMN1; SMN2
SCHEMBL1640293 0.77 FADS1 (0.45) HPGDSMN1; SMN2NPC1RAB9AMEN1
SCHEMBL1641840 0.76 EGFR (0.51) KDR
SCHEMBL13815929 0.75 HDAC1 (0.58) HDAC1HDAC6GRM1HPGDSMN1; SMN2
SCHEMBL12058600 0.75 RAB9A (0.41) HDAC1HDAC6HPGDSMN1; SMN2NPC1
SCHEMBL13105480 0.75 PDGFRB (0.45) HDAC1HDAC6GRM1HPGDSMN1; SMN2
SCHEMBL12726488 0.74 ALDH1A1 (0.55) HPGDSMN1; SMN2POLBALDH1A1LMNA
SCHEMBL24760920 0.73 ERCC5 (0.47) SMN1; SMN2NPC1RAB9AMEN1KMT2A

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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 US disclosed
US-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors GLAXOSMITHKLINE LLC 2011-04-28 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-20110098296-A1 Thiazole And Oxazole Kinase Inhibitors PDXK, MAP3K1, MAP4K2 HDAC1 680/4885HDAC6 694/4885GRM1 863/4885

“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.