SCHEMBL8473259

SCHEMBL8473259

CCOC(=O)c1c(C(c2ccccc2)c2ccc(OCc3ccccc3)cc2)c2ccccc2n1CCN(C)C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
EGFR P00533 4/20 0.44
PTGER4 P35408 1/20 0.43
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LTB4R Q15722 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.40
MEN1 O00255 2/20 0.40
ALOX5 P09917 2/20 0.39
HSP90AA1 P07900 1/20 0.39

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
SCHEMBL8476671 0.91 KMT2A (0.47) KMT2AEGFRPTGER4MEN1
SCHEMBL8472891 0.90 EGFR (0.45) EGFRLTB4RLTB4R2ALOX5
SCHEMBL8476486 0.90 PTGER4 (0.50) KMT2APTGER4LMNAL3MBTL1MEN1
SCHEMBL8472573 0.89 KMT2A (0.44) KMT2APTGER4MEN1
SCHEMBL7609587 0.88 KMT2A (0.46) KMT2APTGER4LMNAMEN1
SCHEMBL8474896 0.87 EGFR (0.47) EGFRPTGER4L3MBTL1
SCHEMBL8479371 0.86 PTGER4 (0.41) KMT2APTGER4LMNAMEN1
SCHEMBL8472402 0.86 PTGER4 (0.49) KMT2APTGER4LMNAL3MBTL1MEN1
SCHEMBL8479051 0.86 EGFR (0.41) EGFRALOX5
SCHEMBL8472561 0.85 HDAC3 (0.41) KMT2AEGFRALOX5

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-5891902-A OSTEOPOROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-04-06 US disclosed
EP-0782989-A1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-07-09 EP disclosed