SCHEMBL4811142

SCHEMBL4811142

COC(=O)C1(Cc2ccccc2)CCCC1OC(=O)c1cccc(C)c1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.40
RAB9A P51151 5/20 0.40
ADAM17 P78536 3/20 0.40
NPC1 O15118 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPT P10636 1/20 0.39
GPR52 Q9Y2T5 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
GRM5 P41594 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL4808723 0.94 RAB9A (0.41) RAB9ANPC1SMN1; SMN2NPSR1MAPT
SCHEMBL4806545 0.92 MEN1 (0.42) OPRK1RAB9AADAM17NPC1L3MBTL1
SCHEMBL4817586 0.90 ADAM17 (0.43) ADAM17SMN1; SMN2
SCHEMBL4809655 0.90 RAB9A (0.43) OPRK1RAB9ANPC1L3MBTL1SMN1; SMN2
SCHEMBL4812200 0.89 RAB9A (0.41) OPRK1RAB9ANPC1L3MBTL1SMN1; SMN2
SCHEMBL4808773 0.88 ADAM17 (0.41) OPRK1RAB9AADAM17NPC1SMN1; SMN2
SCHEMBL4808768 0.88 ADAM17 (0.41) RAB9AADAM17NPC1SMN1; SMN2
SCHEMBL4815578 0.87 SMN1; SMN2 (0.42) RAB9ANPC1L3MBTL1SMN1; SMN2NPSR1
SCHEMBL4810961 0.86 TP53 (0.39) RAB9AADAM17NPC1L3MBTL1SMN1; SMN2
SCHEMBL4805258 0.85 SMN1; SMN2 (0.41) RAB9ANPC1L3MBTL1SMN1; SMN2NPSR1

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-7388103-B2 Cyclopentane carboxylate compounds, process and intermediates for preparing the same and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-06-17 US disclosed
US-20060094843-A1 Cyclopentane carboxylate compounds, process and intermediates for preparing the same and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2006-05-04 US disclosed
WO-2006045246-A1 CYCLOPENTANE CARBOXYLATE COMPOUNDS, PROCESS AND INTERMEDIATES FOR PREPARING THE SAME AND USE THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2006-05-04 WO 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-20060094843-A1 Cyclopentane carboxylate compounds, process and intermediates for preparing the same and use thereof C5, C1S, AKR1C3 OPRK1 1007/4885RAB9A 3676/4885ADAM17 2714/4885

“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.