SCHEMBL9033182

SCHEMBL9033182

CCCCC(c1ccccc1C)n1ccc2cc(CC(C)=CC(=O)O)ccc21

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.35
ITGAV P06756 2/20 0.35
ITGB5 P18084 1/20 0.35
OXER1 Q8TDS5 1/20 0.33

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
SCHEMBL9033253 0.94 SLC6A2 (0.38) ITGB3ITGAVITGB5
SCHEMBL9033912 0.89 ITGB3 (0.41) ITGB3ITGAVITGB5
SCHEMBL9034267 0.87 ITGB3 (0.41) ITGB3ITGAVITGB5
SCHEMBL9033445 0.86 ITGB3 (0.35) ITGB3ITGAVITGB5OXER1
SCHEMBL9033177 0.85
SCHEMBL9033189 0.85
SCHEMBL9035231 0.84 SLC6A2 (0.36) ITGB3ITGAVITGB5
SCHEMBL9033809 0.83 SLC6A2 (0.46) ITGB3ITGAVITGB5
SCHEMBL9033330 0.83 ITGB3 (0.41) ITGB3ITGAVOXER1
SCHEMBL9032684 0.83 ITGB3 (0.35) ITGB3ITGAVITGB5

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-0511477-B1 Indole derivatives KYOWA HAKKO KOGYO KK (JP) 1996-07-10 EP disclosed
US-5239083-A Anticarcinogenic agents, prostate cancer treatment KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-08-24 US disclosed
EP-0511477-A1 Indole derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-11-04 EP disclosed