SCHEMBL7187047

SCHEMBL7187047

COc1ccc2ccccc2c1CCN1CCN(C)C(C(c2ccccc2)c2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MC4R P32245 7/20 0.46
HTT P42858 1/20 0.44
SLC6A4 P31645 1/20 0.41
KDM1A O60341 1/20 0.40
MAOA P21397 1/20 0.40
POLB P06746 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
SCHEMBL6541547 0.91 MEN1 (0.58) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL6540815 0.79 TACR1 (0.55) KMT2AMEN1
SCHEMBL31618176 0.76 KMT2A (0.59) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL31618261 0.76 KMT2A (0.59) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL6540941 0.74 TACR1 (0.56) KMT2AMEN1
SCHEMBL7205927 0.74 HTT (0.55) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL6541329 0.74 HTT (0.55) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL7205922 0.74 HTT (0.55) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL6541677 0.74 TACR1 (0.44) KMT2AMEN1ALDH1A1MAPTTSHR
Hydrochloric Acid SCHEMBL6541598 0.74 TACR1 (0.51) KMT2AMEN1

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
EP-1294700-A2 BENZHYDRYL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-26 EP disclosed
WO-2002000631-A2 BENZHYDRYL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 WO disclosed