SCHEMBL9419831

SCHEMBL9419831

COc1cccc(/C=C/c2cccc(O)c2)c1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.83
BCR P11274 1/20 0.83
RELA Q04206 1/20 0.70
NFE2L2 Q16236 3/20 0.66
CYP19A1 P11511 1/20 0.64
NQO2 P16083 1/20 0.64
LCK P06239 1/20 0.62
TUBB4A P04350 1/20 0.62
TUBB P07437 1/20 0.62
TUBA3C P0DPH7 1/20 0.62
TUBA1B P68363 1/20 0.62
TUBA4A P68366 1/20 0.62
TUBB4B P68371 1/20 0.62
TUBB3 Q13509 1/20 0.62
TUBB2A Q13885 1/20 0.62
TUBB8 Q3ZCM7 1/20 0.62
TUBA3E Q6PEY2 1/20 0.62
TUBA1A Q71U36 1/20 0.62
TUBA1C Q9BQE3 1/20 0.62
TUBB6 Q9BUF5 1/20 0.62

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
SCHEMBL9419833 1.00 ABL1 (0.83) ABL1BCRRELANFE2L2CYP19A1
SCHEMBL23754584 0.91 ABL1 (1.00) ABL1BCRCYP19A1NQO2LCK
SCHEMBL23754583 0.91 ABL1 (1.00) ABL1BCRCYP19A1NQO2LCK
SCHEMBL23754270 0.91 ABL1 (1.00) ABL1BCRCYP19A1NQO2LCK
SCHEMBL23754271 0.91 ABL1 (1.00) ABL1BCRCYP19A1NQO2LCK
SCHEMBL700055 0.90 RELA (0.84) ABL1BCRRELANFE2L2CYP19A1
SCHEMBL31317665 0.90 RELA (0.84) ABL1BCRRELANFE2L2CYP19A1
SCHEMBL700056 0.90 RELA (0.84) ABL1BCRRELANFE2L2CYP19A1
SCHEMBL23158820 0.90 RELA (0.84) ABL1BCRRELANFE2L2CYP19A1
SCHEMBL22245457 0.89 ABL1 (0.90) ABL1BCRRELANQO2LCK

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-5314693-A Hydroxystilbene compounds KIORITZ CORPORATION (JP) 1994-05-24 US claimed
US-5314693-A Hydroxystilbene compounds KIORITZ CORPORATION (JP) 1994-05-24 US disclosed