SCHEMBL16719652

SCHEMBL16719652

COc1[c]cccc1-c1cccc(F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 2/20 0.40
TUBB P07437 2/20 0.40
TUBA3C P0DPH7 2/20 0.40
TUBA1B P68363 2/20 0.40
TUBA4A P68366 2/20 0.40
TUBB4B P68371 2/20 0.40
TUBB3 Q13509 2/20 0.40
TUBB2A Q13885 2/20 0.40
TUBB8 Q3ZCM7 2/20 0.40
TUBA3E Q6PEY2 2/20 0.40
TUBA1A Q71U36 2/20 0.40
TUBA1C Q9BQE3 2/20 0.40
TUBB6 Q9BUF5 2/20 0.40
TUBB2B Q9BVA1 2/20 0.40
TUBB1 Q9H4B7 2/20 0.40
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
FYN P06241 4/20 0.38
PDE4B Q07343 2/20 0.37
KIT P10721 1/20 0.36

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
SCHEMBL6191314 0.87 ABL1 (0.33) FYNHTR1AHTR7
SCHEMBL5779607 0.82 CYP1A1 (0.45) ALDH1A1HTR1AHTR7
SCHEMBL9180615 0.82 ACHE (0.40) PDGFRBPDGFRAFYNKITKDM4E
SCHEMBL6985969 0.81 SLC6A4 (0.42) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL17514815 0.81 NOTUM (0.41) FYNPDE4BHTR7MAPK10
SCHEMBL4288028 0.81 HSD17B1 (0.41) FYN
SCHEMBL17514495 0.80 AKR1C3 (0.43) KDM4EALDH1A1HPGDHTR1AHTR7
SCHEMBL17514985 0.80 CHRM3 (0.36)
SCHEMBL16719415 0.80 PGR (0.35) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL3535486 0.79 ALDH1A1 (0.39) PDE4BKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3068758-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE The Wistar Institute Of Anatomy And Biology (US) 2016-09-21 EP disclosed
WO-2016026830-A1 NOVEL FUNGICIDAL PYRAZOLE DERIVATIVES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-02-25 WO disclosed
WO-2015073864-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2015-05-21 WO disclosed