SCHEMBL8430201

SCHEMBL8430201

COc1cc(OC)c(C(=O)/C(C)=C/c2c[nH]c3ccccc23)cc1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TUBB4A P04350 2/20 0.52
▸ TUBB P07437 2/20 0.52
▸ TUBA3C P0DPH7 2/20 0.52
▸ TUBA1B P68363 2/20 0.52
▸ TUBA4A P68366 2/20 0.52
▸ TUBB4B P68371 2/20 0.52
▸ TUBB3 Q13509 2/20 0.52
▸ TUBB2A Q13885 2/20 0.52
▸ TUBB8 Q3ZCM7 2/20 0.52
▸ TUBA3E Q6PEY2 2/20 0.52
▸ TUBA1A Q71U36 2/20 0.52
▸ TUBA1C Q9BQE3 2/20 0.52
▸ TUBB6 Q9BUF5 2/20 0.52
▸ TUBB2B Q9BVA1 2/20 0.52
▸ TUBB1 Q9H4B7 2/20 0.52
▸ SNCA P37840 1/20 0.50
▸ POLB P06746 3/20 0.48
▸ KMT2A Q03164 5/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ KDM4E B2RXH2 2/20 0.47

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
SCHEMBL8430204 1.00 TUBB4A (0.52) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8434216 0.87 TUBB1 (0.54) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8434218 0.87 TUBB1 (0.54) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL30734337 0.85 TUBB4A (0.59) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL22950670 0.85 TUBB4A (0.59) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL30734311 0.85 TUBB4A (0.59) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8432530 0.84 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8432535 0.84 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7823509 0.82 TUBB1 (0.74) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL31238100 0.82 TUBB1 (0.74) 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
US-5952355-A 1-ETHER-SUBSTITUTED PHENYL-3-INDOL-3-YL-2-PROPEN-1-ONE DERIVATIVES; ANTITUMOR AND -CARCINOGENIC AGENTS; IMMUNOSUPPRESSANTS; AUTOIMMUNE DISEASES; SIDE EFFECT REDUCTION KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-09-14 — — US disclosed
EP-0770601-A1 PROPENONE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-05-02 — — EP disclosed
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