SCHEMBL8474409

SCHEMBL8474409

COCOc1ccc(C(c2ccc(OCOC)cc2)c2c(C(=O)NCCc3ccncc3)n(CCN(C)C)c3ccccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.42
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
PTGER4 P35408 1/20 0.35
LMNA P02545 3/20 0.35
TP53 P04637 2/20 0.34
SMPD1 P17405 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
TAS1R2 Q8TE23 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
RAB9A P51151 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL8796410 0.93 LMNA (0.40) NPY5RMEN1KMT2APOLBMAPT
SCHEMBL8472329 0.90 EGFR (0.41) MEN1KMT2APOLBMAPTPTGER4
SCHEMBL8472678 0.89 RAB9A (0.40) POLBMAPTPTGER4LMNATP53
SCHEMBL7616866 0.88 PTGER4 (0.38) MEN1KMT2APOLBMAPTPTGER4
SCHEMBL8476050 0.88 NPY5R (0.47) NPY5RMEN1KMT2APOLBMAPT
SCHEMBL8472634 0.87 PTGER4 (0.34) MEN1KMT2APOLBMAPTPTGER4
SCHEMBL8475833 0.86 KDM4E (0.42) MEN1KMT2APOLBLMNATP53
SCHEMBL8472045 0.85 GAA (0.44) MEN1KMT2AMAPTL3MBTL1TP53
SCHEMBL8475172 0.84 ALDH1A1 (0.42) MEN1KMT2AMAPTLMNATP53
SCHEMBL8477343 0.84 KDM4E (0.41) MEN1KMT2APOLBMAPTL3MBTL1

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-0782988-A1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-07-09 EP disclosed