SCHEMBL17014336

SCHEMBL17014336

CC(=O)c1ccc(C)c2c1C(C)CC2

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NOTUM Q6P988 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HCAR2 Q8TDS4 1/20 0.31
ACHE P22303 1/20 0.30
POLQ O75417 1/20 0.30

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
SCHEMBL17014323 0.83 ALDH1A1 (0.47) DRD2ALDH1A1HPGDGAAMAPT
SCHEMBL17014320 0.80 KDM4E (0.44) ALDH1A1HPGDGAAMAPTNOTUM
SCHEMBL28676003 0.78 CYP2A6 (0.33) ALDH1A1ACHE
SCHEMBL17014337 0.76 HSD17B1 (0.39) DRD2ALDH1A1HPGDGAAMAPT
SCHEMBL5145610 0.74 HCAR2 (0.40) ALDH1A1HPGDMAPTALOX15MAPK1
SCHEMBL23691473 0.72 SLC6A2 (0.30) ALDH1A1ACHE
SCHEMBL15746283 0.72 MAOA (0.36) ALDH1A1HPGDGAAMAPTALOX15
SCHEMBL17014298 0.72 CYP2A6 (0.30) ALDH1A1ACHE
SCHEMBL29628522 0.71 DRD2 (0.57) DRD2ALDH1A1HPGDKDM4E
SCHEMBL20872759 0.71 DRD2 (0.57) DRD2ALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-08-20 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-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS HAVCR2, SLC10A1, SORD DRD2 3934/4885ALDH1A1 588/4885HPGD 302/4885

“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.