SCHEMBL8472891

SCHEMBL8472891

CN(C)CCn1c(C(=O)O)c(C(c2ccccc2)c2ccc(OCc3ccccc3)cc2)c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.45
LTA4H P09960 1/20 0.41
ALOX5 P09917 3/20 0.41
NPY5R Q15761 1/20 0.41
LTB4R Q15722 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.41
MAOB P27338 1/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL8475829 0.90 PLA2G2A (0.42) LTA4HMAPT
SCHEMBL8479051 0.90 EGFR (0.41) EGFRLTA4HALOX5NPY5RMAOB
SCHEMBL8473259 0.90 KMT2A (0.45) EGFRALOX5LTB4RLTB4R2
SCHEMBL8472561 0.88 HDAC3 (0.41) EGFRLTA4HALOX5NPY5R
SCHEMBL8477366 0.88 ALDH1A1 (0.47) MAPT
SCHEMBL7612724 0.87 ALDH1A1 (0.39) MAPT
SCHEMBL8472046 0.85 SLC6A5 (0.43) MAOB
SCHEMBL8472006 0.85 HTT (0.52) EGFRLTA4H
SCHEMBL8898763 0.84 TSPO (0.38) LTB4RLTB4R2
SCHEMBL8473687 0.84 LTA4H (0.44) LTA4HNPY5RMAPT

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