SCHEMBL2277708

SCHEMBL2277708

Cc1cc(O)c(C(=O)C=Cc2cccc(C(=O)NCCO)c2)c(=O)n1C

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 1/20 0.41
P4HB P07237 4/20 0.38
MAPT P10636 3/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PDE7A Q13946 1/20 0.38
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.36
SLC5A1 P13866 1/20 0.36
SLC5A2 P31639 1/20 0.36
PDCD1 Q15116 1/20 0.36
CD274 Q9NZQ7 1/20 0.36

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
SCHEMBL2277707 1.00 NPC1 (0.42) NPC1RAB9AKDM4EP4HBMAPT
SCHEMBL2279853 0.90 P4HB (0.41) NPC1RAB9AKDM4EP4HBMAPT
SCHEMBL2279851 0.90 P4HB (0.41) NPC1RAB9AKDM4EP4HBMAPT
SCHEMBL2284353 0.88 NPC1 (0.42) NPC1RAB9AP4HBMAPTUSP2
SCHEMBL2284349 0.88 NPC1 (0.42) NPC1RAB9AP4HBMAPTUSP2
SCHEMBL2277068 0.88 KDM4E (0.43) KDM4EP4HBMAPTPOLBNPSR1
SCHEMBL2277074 0.88 KDM4E (0.43) KDM4EP4HBMAPTPOLBNPSR1
SCHEMBL2281516 0.87 NPC1 (0.41) NPC1RAB9AP4HBMAPTUSP2
SCHEMBL2281525 0.87 NPC1 (0.41) NPC1RAB9AP4HBMAPTUSP2
SCHEMBL2281265 0.87 P4HB (0.41) NPC1RAB9AP4HBMAPTUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989478-B2 decreases expression of a Type I collage gene in a tissue to induce a reduction in accumulation of collagen and thereby improves tissue fibrosis SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-02 US disclosed
US-20060211680-A1 decreases expression of a Type I collage gene in a tissue to induce a reduction in accumulation of collagen and thereby improves tissue fibrosis SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-09-21 US disclosed
EP-1671948-A1 CINNAMOYL COMPOUND AND USE OF THE SAME Sumitomo Chemical Company, Limited (JP) 2006-06-21 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-20060211680-A1 decreases expression of a Type I collage gene in a tissue to induce a reduction in accumulation of collagen and thereby improves tissue fibrosis COL2A1, COL1A1, COL14A1 NPC1 1610/4885RAB9A 3791/4885KDM4E 2443/4885

“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.