SCHEMBL1712950

SCHEMBL1712950

OCCC12CC3CC(CC(O)(C3)C1)C2

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
PKM P14618 1/20 0.45
HSD11B1 P28845 2/20 0.39
ALDH1A1 P00352 3/20 0.36
GRIN2D O15399 4/20 0.35
GRIN3B O60391 4/20 0.35
GRIN1 Q05586 4/20 0.35
GRIN2A Q12879 4/20 0.35
GRIN2B Q13224 4/20 0.35
GRIN2C Q14957 4/20 0.35
GRIN3A Q8TCU5 4/20 0.35
GAA P10253 1/20 0.35
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL602384 0.87 GAA (0.44) ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL18788534 0.83 PKM (0.48) MAPTHPGDPKMHSD11B1ALDH1A1
SCHEMBL1044999 0.83 PKM (0.48) MAPTHPGDPKMHSD11B1ALDH1A1
SCHEMBL18788533 0.83 PKM (0.48) MAPTHPGDPKMHSD11B1ALDH1A1
SCHEMBL17818867 0.82 GRIN2D (0.59) MAPTHPGDPKMHSD11B1ALDH1A1
SCHEMBL1712949 0.82 MAPT (0.48) MAPTHPGDPKMHSD11B1ALDH1A1
SCHEMBL6904455 0.82 MAPT (0.44) MAPTHPGDPKMHSD11B1ALDH1A1
SCHEMBL28253727 0.81 ALDH1A1 (0.45) MAPTHPGDALDH1A1GRIN2DGRIN3B
SCHEMBL14696671 0.79 MAPT (0.43) MAPTHPGDPKMHSD11B1ALDH1A1
SCHEMBL16269329 0.78 GRIN2D (0.60) PKMALDH1A1GRIN2DGRIN3BGRIN1

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 MAPT 789/4885HPGD 572/4885PKM 16/4885
US-20100240634-A1 Fluorene Compound and Pharmaceutical Use Thereof FH, PCK2, PC MAPT 789/4885HPGD 572/4885PKM 16/4885
US-20130274240-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC MAPT 789/4885HPGD 572/4885PKM 16/4885
US-20190177271-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC MAPT 789/4885HPGD 572/4885PKM 16/4885
US-20200308109-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC MAPT 789/4885HPGD 572/4885PKM 16/4885

“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.