SCHEMBL28155404

SCHEMBL28155404

COc1cc2ccocc-2c1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.54
PDGFRB P09619 1/20 0.47
TUBB4A P04350 10/20 0.45
TUBB P07437 10/20 0.45
TUBA3C P0DPH7 10/20 0.45
TUBA1B P68363 10/20 0.45
TUBA4A P68366 10/20 0.45
TUBB4B P68371 10/20 0.45
TUBB3 Q13509 10/20 0.45
TUBB2A Q13885 10/20 0.45
TUBB8 Q3ZCM7 10/20 0.45
TUBA3E Q6PEY2 10/20 0.45
TUBA1A Q71U36 10/20 0.45
TUBA1C Q9BQE3 10/20 0.45
TUBB6 Q9BUF5 10/20 0.45
TUBB2B Q9BVA1 10/20 0.45
TUBB1 Q9H4B7 10/20 0.45
ERN1 O75460 1/20 0.44
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42

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
SCHEMBL2751742 0.75 TUBB4A (0.49) FYNPDGFRBTUBB4ATUBBTUBA3C
SCHEMBL28238947 0.74 FYN (0.64) FYNPDGFRBTUBB4ATUBBTUBA3C
SCHEMBL2751688 0.72 PDE4A (0.53) FYNPDGFRBTUBB4ATUBBTUBA3C
SCHEMBL20485781 0.71 FYN (1.00) FYN
Ammonia Solution, Strong SCHEMBL6204421 0.69 FYN (0.52) FYNKDM4EALDH1A1HPGDL3MBTL1
SCHEMBL28060862 0.68 FYN (0.57) FYNTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL2753374 0.68 ALDH1A1 (0.48) FYNERN1KDM4EALDH1A1HPGD
SCHEMBL14003496 0.68 ACHE (0.47) FYNTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5686777 0.68 CYP1A1 (0.65) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5686772 0.68 CYP1A1 (0.65) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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
CN-103052640-B Furopyridine Derivatives 默克专利股份公司 2017-06-30 CN claimed
CN-103052640-B Furopyridine Derivatives 默克专利股份公司 2017-06-30 CN disclosed