SCHEMBL12430606

SCHEMBL12430606

CC(=O)NC1c2ccccc2-c2c(-c3nc4ccncc4[nH]3)cccc21

nearest known ligand 0.80

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 5/20 0.80
PDE5A O76074 4/20 0.49
HPSE Q9Y251 1/20 0.43
METAP2 P50579 1/20 0.42
METAP1 P53582 1/20 0.42
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
ADORA3 P0DMS8 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
JMJD6 Q6NYC1 1/20 0.39
FGFR1 P11362 1/20 0.38
FLT1 P17948 1/20 0.38
AURKA O14965 1/20 0.38
APLNR P35414 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
SCHEMBL13437168 0.89 HSP90AB1 (0.83) HSP90AB1PDE5AHPSEMETAP2METAP1
SCHEMBL13437166 0.89 HSP90AB1 (1.00) HSP90AB1PDE5AHPSEMETAP2METAP1
SCHEMBL12430894 0.88 HSP90AB1 (0.78) HSP90AB1PDE5AHPSEMETAP2METAP1
SCHEMBL12431194 0.87 HSP90AB1 (0.79) HSP90AB1PDE5AHPSEMETAP2METAP1
SCHEMBL13437167 0.87 HSP90AB1 (0.85) HSP90AB1PDE5AHPSEMETAP2METAP1
SCHEMBL12431614 0.86 HSP90AB1 (0.77) HSP90AB1PDE5AHPSESMN1; SMN2JMJD6
SCHEMBL12430906 0.86 HSP90AB1 (0.78) HSP90AB1PDE5AHPSEMETAP2METAP1
SCHEMBL13437212 0.86 HSP90AB1 (0.78) HSP90AB1PDE5AHPSEMETAP2METAP1
SCHEMBL2314870 0.86 HSP90AB1 (0.75) HSP90AB1PDE5AHPSEMETAP2METAP1
SCHEMBL13437206 0.86 HSP90AB1 (0.78) HSP90AB1PDE5AHPSEMETAP2METAP1

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 HSP90AB1 2/4885PDE5A 2779/4885HPSE 3194/4885

“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.