SCHEMBL11209111

SCHEMBL11209111

CCCCCCNN1CCCC1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.41
GNAI3 P08754 1/20 0.41
GNAO1 P09471 1/20 0.41
GNAI1 P63096 1/20 0.41
EPHX1 P07099 1/20 0.38
ADH1B P00325 1/20 0.38
ADH1C P00326 1/20 0.38
ADH1A P07327 1/20 0.38
ADH4 P08319 1/20 0.38
ADH7 P40394 1/20 0.38
FAAH O00519 2/20 0.37
MGLL Q99685 2/20 0.37
BRD4 O60885 1/20 0.35
BRD2 P25440 1/20 0.35
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.34
BCHE P06276 5/20 0.34
ACHE P22303 5/20 0.34

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
SCHEMBL28186866 0.98 ALOX5 (0.39) ALOX5GNAI3GNAO1GNAI1EPHX1
SCHEMBL8915607 0.87 GNAI3 (0.41) ALOX5GNAI3GNAO1GNAI1EPHX1
SCHEMBL7098874 0.86 ALDH1A1 (0.34) ALOX5ALDH1A1HSD17B10GAA
SCHEMBL1306308 0.85 BRD4 (0.40) ALOX5BRD4BRD2ALDH1A1HSD17B10
SCHEMBL7368280 0.79 TSHR (0.34) BRD4BRD2
SCHEMBL9264820 0.77
SCHEMBL6645161 0.74 BRD4 (0.35) BRD4BRD2
SCHEMBL22163800 0.74 LMNA (0.38) BRD4BRD2ALDH1A1
SCHEMBL17202712 0.74 GNAI3 (0.42) ALOX5GNAI3GNAO1GNAI1EPHX1
SCHEMBL28722158 0.74 GNAI3 (0.42) ALOX5GNAI3GNAO1GNAI1EPHX1

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
EP-0031065-B1 NAPHTHALINE-TETRACARBONIC ACID DIIMIDES AS ELECTRICAL SEMICONDUCTORS AND PHOTOCONDUCTORS BAYER AG (DE) 1983-10-12 EP disclosed
EP-0031065-A2 Naphthaline-tetracarbonic acid diimides as electrical semiconductors and photoconductors BAYER AG (DE) 1981-07-01 EP disclosed