SCHEMBL2317573

SCHEMBL2317573

N#Cc1ccc2c(c1)/C(=N/O)c1cccc(-c3nc4ccccc4[nH]3)c1-2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ PDE10A Q9Y233 1/20 0.43
▸ F7 P08709 1/20 0.43
▸ METAP2 P50579 1/20 0.42
▸ METAP1 P53582 1/20 0.42
▸ IRAK4 Q9NWZ3 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.41
▸ NPC1 O15118 4/20 0.41
▸ HPGD P15428 4/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ PKM P14618 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GPR55 Q9Y2T6 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL2308883 0.90 METAP2 (0.43) RAB9AKDM4EPDE10AF7METAP2
SCHEMBL2308879 0.90 METAP2 (0.43) RAB9AKDM4EPDE10AF7METAP2
SCHEMBL2309658 0.84 RAB9A (0.55) RAB9AKDM4EF7ALDH1A1NPC1
SCHEMBL2309662 0.84 RAB9A (0.55) RAB9AKDM4EF7ALDH1A1NPC1
SCHEMBL12431585 0.84 RAB9A (0.55) RAB9AKDM4EF7ALDH1A1NPC1
SCHEMBL2312932 0.84 NPC1 (0.45) RAB9AKDM4EPDE10AF7METAP2
SCHEMBL2314019 0.83 AMY1A (0.47) RAB9AKDM4EF7ALDH1A1NPC1
SCHEMBL2314021 0.83 AMY1A (0.47) RAB9AKDM4EF7ALDH1A1NPC1
SCHEMBL9725329 0.80 METAP2 (0.53) RAB9AKDM4EPDE10AMETAP2METAP1
SCHEMBL2310794 0.75 NPC1 (0.46) RAB9AKDM4EF7ALDH1A1NPC1

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 RAB9A 1012/4885KDM4E 3419/4885PDE10A 3306/4885

“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.

Send feedback