SCHEMBL2051544

SCHEMBL2051544

c1ccc(C[C]2CCCCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.52
POLB P06746 1/20 0.44
LTA4H P09960 6/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
IDH1 O75874 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
HRH1 P35367 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
PLA2G10 O15496 1/20 0.39
PLA2G2A P14555 1/20 0.39

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
SCHEMBL6586984 1.00 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1
SCHEMBL1829180 1.00 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1
SCHEMBL2045801 0.97 CALM1 (0.55) CALM1POLBLTA4HIDH1HRH1
SCHEMBL1829354 0.92 CALM1 (0.55) CALM1LTA4HHRH3
SCHEMBL2973782 0.87 CALM1 (0.61) CALM1LTA4HIDH1
Diphenylmethane SCHEMBL28085719 0.81 CALM1 (0.80) CALM1LTA4HIDH1HRH3PLA2G10
Diphenylmethane SCHEMBL28072604 0.81 CALM1 (0.80) CALM1LTA4HIDH1HRH3PLA2G10
SCHEMBL438098 0.80 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1
SCHEMBL21807128 0.80 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1
SCHEMBL19306461 0.80 CALM1 (0.52) CALM1POLBLTA4HL3MBTL1IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023101004-A1 OLEFIN RESIN, METHOD FOR MANUFACTURING SAME, AND APPLICATION FOR SAME 三井化学株式会社 2023-06-08 WO disclosed
CN-108727152-A Cis-stilbene/fluorene derivative material and organic light emitting diode component 杰秀有限公司 2018-11-02 CN disclosed
CN-108727153-A Cis-stilbene/fluorene derivative material and organic light emitting diode component 杰秀有限公司 2018-11-02 CN disclosed
US-7960588-B2 Benzyl cycloalkyl sphingosine 1-phosphate receptor modulators UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2011-06-14 US disclosed
US-20100249074-A1 BENZYL-CYCLOALKYL SPHINGOSINE 1-PHOSPHATE RECEPTOR MODULATORS UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2010-09-30 US disclosed
EP-2203409-A2 BENZYL-CYCLOALKYL SPHINGOSINE 1-PHOSPHATE RECEPTOR MODULATORS University Of Virginia Patent Foundation (US) 2010-07-07 EP disclosed
WO-2009043013-A2 BENZYL-CYCLOALKYL SPHINGOSINE 1-PHOSPHATE RECEPTOR MODULATORS UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2009-04-02 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-20100249074-A1 BENZYL-CYCLOALKYL SPHINGOSINE 1-PHOSPHATE RECEPTOR MODULATORS S1PR1, S1PR3, S1PR4 CALM1 2683/4885POLB 3124/4885LTA4H 897/4885

“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.