SCHEMBL715856

SCHEMBL715856

[c]1ccccc1-n1c(-c2ccccc2)ccc1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
KDM4E B2RXH2 3/20 0.42
XBP1 P17861 1/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 6/20 0.34
PKM P14618 3/20 0.34
HTT P42858 1/20 0.34
PCSK9 Q8NBP7 1/20 0.32
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
HPGD P15428 2/20 0.32
CHEK1 O14757 1/20 0.32
MAP4K4 O95819 1/20 0.32
CSF1R P07333 1/20 0.32
PRKACA P17612 1/20 0.32
KDR P35968 1/20 0.32
CDK8 P49336 1/20 0.32
MAP2K1 Q02750 1/20 0.32
ACVR1 Q04771 1/20 0.32
MAP4K2 Q12851 1/20 0.32

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
SCHEMBL21799211 0.78 MAPT (0.45) MAPTKDM4EXBP1MAPK1ALDH1A1
SCHEMBL713625 0.77 KMT2A (0.49) KDM4EALDH1A1KMT2AHPGDKDR
SCHEMBL715512 0.76 KMT2A (0.45) KDM4EMAPK1ALDH1A1KMT2AHPGD
SCHEMBL715182 0.73 ALDH1A1 (0.39) MAPTKDM4EXBP1MAPK1ALDH1A1
SCHEMBL8504546 0.71 PTGS2 (0.66) MAPTKDM4EALDH1A1HPGDPTGS2
SCHEMBL713751 0.71 EGFR (0.45) MAPTKDM4EMAPK1ALDH1A1MEN1
SCHEMBL28341418 0.71 TSPO (0.35) ALDH1A1PKMHTTMAP4K4
SCHEMBL715625 0.69 ESR1 (0.54) MAPTKDM4EMAPK1ALDH1A1PKM
SCHEMBL715857 0.68 MAPT (0.44) MAPTKDM4EXBP1MAPK1ALDH1A1
SCHEMBL715990 0.68 KDM4E (0.46) MAPTKDM4EALDH1A1HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8771843-B2 Fluorene derivative, organic compound, and light-emitting element, light-emitting device, and electronic device using the compound SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-07-08 US disclosed
US-20120049768-A1 Fluorene Derivative, Organic Compound, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Compound SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-01 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-20120049768-A1 Fluorene Derivative, Organic Compound, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Compound AFF2, MAPRE2, AFF4 MAPT 372/4885KDM4E 2863/4885XBP1 2583/4885

“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.