SCHEMBL4815646

SCHEMBL4815646

COC(=O)C1(c2ccc(C)cc2)CCCC1OC(=O)c1cccc(C)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
HTR2C P28335 1/20 0.39
MAPT P10636 1/20 0.39
ADAM17 P78536 1/20 0.39
OPRK1 P41145 1/20 0.38
LMNA P02545 3/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GPR17 Q13304 1/20 0.37
POLB P06746 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
SCHEMBL4813933 0.93 NPC1 (0.41) SMN1; SMN2NPSR1NPC1RAB9AHTR2C
SCHEMBL4808103 0.90 NPSR1 (0.39) SMN1; SMN2NPSR1NPC1RAB9AMAPT
SCHEMBL4813911 0.90 HTR2C (0.46) HTR2CMEN1KMT2A
SCHEMBL4815711 0.88 TDP1 (0.44) SMN1; SMN2NPC1RAB9AHTR2CMAPT
SCHEMBL4815386 0.87 ADRB2 (0.41) SMN1; SMN2NPSR1NPC1RAB9AHTR2C
SCHEMBL4808284 0.85 HTR2C (0.46) SMN1; SMN2NPSR1HTR2CMAPTADAM17
SCHEMBL4810643 0.84 SLC22A1 (0.43) NPSR1NPC1RAB9AMAPTOPRK1
SCHEMBL4811022 0.82 HTR3E (0.43) HTR2CMEN1KMT2A
SCHEMBL4806457 0.81 SMN1; SMN2 (0.44) SMN1; SMN2NPSR1NPC1RAB9AMAPT
SCHEMBL4812586 0.81 HTR2C (0.42) NPC1RAB9AHTR2CMAPTADAM17

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 SMN1; SMN2 4671/4885NPSR1 3438/4885NPC1 1423/4885

“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.