SCHEMBL12430877

SCHEMBL12430877

Oc1cc2nc[nH]c2cc1F

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.61
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
APEX1 P27695 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
QPCT Q16769 2/20 0.44
QPCTL Q9NXS2 1/20 0.44
PRKCI P41743 1/20 0.41
RAD52 P43351 1/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 1/20 0.39
POLB P06746 2/20 0.38
CTNNB1 P35222 1/20 0.38
WNT3A P56704 1/20 0.38
HTT P42858 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MMP12 P39900 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL1266091 0.83 MAPT (0.70) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL2264663 0.83 MAPT (0.56) MAPTKDM4EALDH1A1APEX1RECQL
Iodide SCHEMBL11586547 0.81 MAPT (0.54) MAPTKDM4EALDH1A1APEX1RECQL
Bromide SCHEMBL11352026 0.81 MAPT (0.54) MAPTKDM4EALDH1A1APEX1RECQL
Hydrochloric Acid SCHEMBL11587377 0.81 MAPT (0.54) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL30490133 0.78 MAPT (0.63) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL14154810 0.78 MAPT (0.63) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL3925343 0.76 MAPT (0.48) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL12113061 0.76 MAPT (0.61) MAPTKDM4EALDH1A1APEX1RECQL
SCHEMBL31153163 0.76 MAPT (0.61) MAPTKDM4EALDH1A1APEX1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888579-B1 NOVEL FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF AVENTIS PHARMA SA (FR) 2011-08-03 EP disclosed
US-7674795-B2 Fluorene derivatives, composition containing said derivatives and the use thereof AVENTIS PHARMA SA (FR) 2010-03-09 US disclosed
US-7674795-B2 Fluorene derivatives, composition containing said derivatives and the use thereof AVENTIS PHARMA SA (FR) 2010-03-09 US disclosed
US-20080153837-A1 Novel Fluorene Derivatives, Composition Containing Said Derivatives and the Use Thereof AVENTIS PHARMA S.A. (FR) 2008-06-26 US disclosed
US-20080153837-A1 Novel Fluorene Derivatives, Composition Containing Said Derivatives and the Use Thereof AVENTIS PHARMA S.A. (FR) 2008-06-26 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 (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-20080153837-A1 Novel Fluorene Derivatives, Composition Containing Said Derivatives and the Use Thereof HSP90B1, HSP90AB1, HSP90AA1 MAPT 844/4885KDM4E 3419/4885ALDH1A1 3050/4885

“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.