SCHEMBL17040211

SCHEMBL17040211

CC1CCC(CSc2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CRBN Q96SW2 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
AR P10275 2/20 0.40
ACHE P22303 1/20 0.38
GRIN2B Q13224 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
POLB P06746 1/20 0.37
THRB P10828 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CTSK P43235 1/20 0.37
AGTR2 P50052 1/20 0.37
FKBP1A P62942 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
SCHEMBL2665515 0.90 ALDH1A1 (0.50) NPC1RAB9ACRBNALDH1A1MAPK1
SCHEMBL15605677 0.89 AGTR2 (0.41) NPC1RAB9ACRBNALDH1A1MAPK1
SCHEMBL22315254 0.83 NPC1 (0.47) NPC1RAB9ACRBNALDH1A1AR
SCHEMBL17037259 0.80 MAOA (0.42) CRBNALDH1A1MAPK1ARGRIN2B
SCHEMBL5180768 0.77 GBA1 (0.53) CRBNALDH1A1MAPK1MAOAMAOB
SCHEMBL9665143 0.77 CRBN (0.41) NPC1RAB9ACRBNALDH1A1MAPK1
Hydrochloric Acid SCHEMBL4239449 0.76 GBA1 (0.52) CRBNALDH1A1MAPK1MAOAMAOB
SCHEMBL5548726 0.74 AGTR2 (0.41) NPC1RAB9ACRBNALDH1A1MAPK1
SCHEMBL5543174 0.74 AGTR2 (0.41) NPC1RAB9ACRBNALDH1A1MAPK1
SCHEMBL5548257 0.74 AGTR2 (0.41) NPC1RAB9ACRBNALDH1A1MAPK1

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-20150238948-A1 POLYMERIC AND SOLID-SUPPORTED CATALYSTS, AND METHODS OF DIGESTING LIGNIN-CONTAINING MATERIALS USING SUCH CATALYSTS Midori Renewables, Inc. (US) 2015-08-27 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-20150238948-A1 POLYMERIC AND SOLID-SUPPORTED CATALYSTS, AND METHODS OF DIGESTING LIGNIN-CONTAINING MATERIALS USING SUCH CATALYSTS LCT, AGL, MGAM NPC1 4480/4885RAB9A 3902/4885CRBN 1256/4885

“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.