SCHEMBL2311273

SCHEMBL2311273

NC1c2ccccc2-c2c(-c3nc4cc(O)ccc4[nH]3)cccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 4/20 0.41
HPGD P15428 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
RAB9A P51151 4/20 0.41
NPC1 O15118 4/20 0.41
KDM4E B2RXH2 3/20 0.41
NPSR1 Q6W5P4 3/20 0.41
GAA P10253 3/20 0.41
ALDH1A1 P00352 3/20 0.41
GLA P06280 2/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
F7 P08709 1/20 0.40
AMY1A P0DUB6 3/20 0.40
HSD17B10 Q99714 1/20 0.39
F2 P00734 2/20 0.38
F10 P00742 2/20 0.38
PLG P00747 2/20 0.38
PLAU P00749 2/20 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
SCHEMBL2311266 1.00 HSP90AB1 (0.41) HSP90AB1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL3553415 0.84 KDM4E (0.46) HSP90AB1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL3553419 0.84 KDM4E (0.46) HSP90AB1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL2314500 0.84 HSP90AB1 (0.43) HSP90AB1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL2315877 0.82 METAP2 (0.40) HSP90AB1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL2310812 0.82 NPBWR1 (0.43) HSP90AB1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL2310810 0.82 NPBWR1 (0.43) HSP90AB1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL2315875 0.82 METAP2 (0.40) HSP90AB1HPGDSMN1; SMN2RAB9ANPC1
SCHEMBL2313933 0.82 F10 (0.42) HSP90AB1RAB9ANPC1ALDH1A1F7
SCHEMBL2312862 0.82 AURKA (0.46) HPGDSMN1; SMN2RAB9ANPC1KDM4E

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-20080153837-A1 Novel Fluorene Derivatives, Composition Containing Said Derivatives and the Use Thereof AVENTIS PHARMA S.A. (FR) 2008-06-26 US disclosed
EP-1888579-A2 NOVEL FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF Aventis Pharma S.A. (FR) 2008-02-20 EP disclosed
WO-2006123061-A2 FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF AVENTIS PHARMA S.A. (FR) 2006-11-23 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-20080153837-A1 Novel Fluorene Derivatives, Composition Containing Said Derivatives and the Use Thereof HSP90B1, HSP90AB1, HSP90AA1 HSP90AB1 2/4885HPGD 2167/4885SMN1; SMN2 1564/4885

“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.