SCHEMBL3582800

SCHEMBL3582800

OC1(c2ccccc2)CC2CCC1C2

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 6/20 0.51
PTGS2 P35354 1/20 0.44
HSD11B1 P28845 2/20 0.40
NPSR1 Q6W5P4 3/20 0.39
LMNA P02545 2/20 0.39
ATM Q13315 2/20 0.39
HTT P42858 1/20 0.39
ALOX5 P09917 1/20 0.37
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL87608 0.82 HSD11B1 (0.55) ALOX5APPTGS2HSD11B1ATMHTT
SCHEMBL11893304 0.82 KMT2A (0.47) ALOX5APHSD11B1MEN1KMT2A
SCHEMBL979119 0.82 ALOX5AP (0.39) ALOX5APPTGS2HSD11B1KMT2A
SCHEMBL18905268 0.82 ALOX5AP (0.39) ALOX5APPTGS2HSD11B1KMT2A
SCHEMBL18905267 0.80 ALOX5AP (0.42) ALOX5APPTGS2HSD11B1ALOX5MEN1
SCHEMBL12948046 0.78 HSD11B1 (0.39) ALOX5APHSD11B1
SCHEMBL87607 0.77 ALOX5AP (0.38) ALOX5APHSD11B1
SCHEMBL13548738 0.77 ALOX5AP (0.38) ALOX5APHSD11B1LMNAKMT2ASMN1; SMN2
SCHEMBL790990 0.77 ALOX5AP (0.67) ALOX5APHSD11B1ALOX5
SCHEMBL18905475 0.76 ALOX5AP (0.38) ALOX5APPTGS2HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230152693-A1 CARBOXYLATE, CARBOXYLIC ACID GENERATOR, RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-05-18 US disclosed
US-20100152185-A1 DIPHENYL SUBSTITUTED CYCLOALKANES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE CHU LIN 2010-06-17 US disclosed
US-7629467-B2 5-lipoxygenase activating protein inhibitors; antiatherosclerotic, antiasthmatic, antiallergic, antiinflammatory and cytoprotective agents MERCK & CO., INC. (US) 2009-12-08 US disclosed
US-20060211677-A1 Diphenyl substituted cycloalkanes, compositions containing such compounds and methods of use MERCK SHARP & DOHME CORP. 2006-09-21 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 (2 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-20060211677-A1 Diphenyl substituted cycloalkanes, compositions containing such compounds and methods of use ALOX5, ALOX15B, ALOX15 ALOX5AP 10/4885PTGS2 22/4885HSD11B1 520/4885
US-20100152185-A1 DIPHENYL SUBSTITUTED CYCLOALKANES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE ALOX5, LTC4S, ALOX15 ALOX5AP 16/4885PTGS2 19/4885HSD11B1 501/4885

“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.