SCHEMBL15747192

SCHEMBL15747192

CCc1ccc2c(c1)OCCc1nc(CC)[nH]c1-2

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.33
KDM4E B2RXH2 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
MAOB P27338 4/20 0.32
MAPK10 P53779 1/20 0.32
RIPK1 Q13546 1/20 0.32
PARP1 P09874 1/20 0.32
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL15747147 0.87 PIK3CD (0.35) GRM5KDM4EPIK3CDPIK3CAPIK3CB
SCHEMBL18948587 0.87 MAOB (0.34) GRM5KDM4EPIK3CDPIK3CAPIK3CB
SCHEMBL17019677 0.87 PARP1 (0.39) MAPK10RIPK1PARP1L3MBTL1
SCHEMBL10141067 0.84 PIK3CA (0.35) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL15747117 0.74 PARP1 (0.39) MAPK10RIPK1PARP1
SCHEMBL10147704 0.74 MMP12 (0.33) KDM4EPIK3CAPIK3CBPIK3CGMAOB
SCHEMBL19521602 0.71 MEN1 (0.33) ALDH1A1MAPTL3MBTL1
SCHEMBL2756732 0.70 ALDH1A1 (0.36) GRM5PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL10147705 0.68 PARP10 (0.39) KDM4EMAOBALDH1A1MAPTRAB9A
SCHEMBL10147709 0.68 PARP10 (0.41) KDM4EMAPK10PARP1NPC1ALDH1A1

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-9802949-B2 Fused ring compounds as hepatitis C virus inhibitors, pharmaceutical compositions and uses thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2017-10-31 US disclosed
US-9303061-B2 Spiro compounds as Hepatitis C virus inhibitors Sunshine Luke Pharma Co., Ltd. (CN) 2016-04-05 US disclosed
US-20140147412-A1 SPIRO COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2014-05-29 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-20140147412-A1 SPIRO COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS HAVCR2, SORD, SLC10A1 GRM5 4415/4885KDM4E 4827/4885PIK3CD 3348/4885

“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.