SCHEMBL1712825

SCHEMBL1712825

COCOCCN1C(=O)CCC1C[O]

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.45
▸ CHRM2 P08172 3/20 0.31
▸ CHRM4 P08173 3/20 0.31
▸ CHRM5 P08912 3/20 0.31
▸ CHRM1 P11229 3/20 0.31
▸ CHRM3 P20309 3/20 0.31
▸ PTGER4 P35408 3/20 0.30
▸ PTGER3 P43115 3/20 0.30
▸ PTGER2 P43116 3/20 0.30

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
SCHEMBL1712827 0.87 PDK2 (0.47) PDK2CHRM2CHRM4CHRM5CHRM1
SCHEMBL13572913 0.72 PTGER4 (0.41) PDK2PTGER4PTGER3PTGER2
SCHEMBL1712650 0.72 PDK2 (0.39) PDK2PTGER4PTGER3PTGER2
SCHEMBL1712646 0.69 PDK2 (0.41) PDK2PTGER4PTGER3PTGER2
SCHEMBL1712727 0.67 — —
SCHEMBL25989676 0.66 GBA1 (0.36) PDK2
SCHEMBL12298851 0.66 MEN1 (0.44) PTGER4PTGER3PTGER2
SCHEMBL14092773 0.65 PTGER4 (0.48) PTGER4PTGER3PTGER2
SCHEMBL13426911 0.64 KMT2A (0.40) PDK2CHRM2CHRM4CHRM5CHRM1
SCHEMBL14839577 0.63 PTGER4 (0.40) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200308109-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC (JP) 2020-10-01 — — US disclosed
US-20190177271-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC (JP) 2019-06-13 — — US disclosed
US-20150329491-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC (JP) 2015-11-19 — — US disclosed
EP-2345629-B1 FLUORENE COMPOUND AND USE THEREOF FOR MEDICAL PURPOSES JAPAN TOBACCO INC (JP) 2015-06-03 — — EP disclosed
US-8871934-B2 Fluorene compound and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2014-10-28 — — US disclosed
US-20130274240-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC (US) 2013-10-17 — — US disclosed
US-8343994-B2 Fluorene compound and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2013-01-01 — — US disclosed
EP-2345629-A1 FLUORENE COMPOUND AND USE THEREOF FOR MEDICAL PURPOSES Japan Tobacco, Inc. (JP) 2011-07-20 — — EP disclosed
US-20100240634-A1 Fluorene Compound and Pharmaceutical Use Thereof JAPAN TOBACCO INC. (JP) 2010-09-23 — — 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 (5 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-20150329491-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC PDK2 8/4885CHRM2 4568/4885CHRM4 4797/4885
US-20100240634-A1 Fluorene Compound and Pharmaceutical Use Thereof FH, PCK2, PC PDK2 8/4885CHRM2 4568/4885CHRM4 4797/4885
US-20130274240-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC PDK2 8/4885CHRM2 4568/4885CHRM4 4797/4885
US-20190177271-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC PDK2 8/4885CHRM2 4568/4885CHRM4 4797/4885
US-20200308109-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC PDK2 8/4885CHRM2 4568/4885CHRM4 4797/4885

“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.

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