SCHEMBL6966146

SCHEMBL6966146

O=CNc1c(N2CCN(c3ccccc3)CC2)n[nH]c1-c1cccc(Br)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.43
MAPT P10636 9/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TACR3 P29371 1/20 0.37
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
HTR7 P34969 1/20 0.35
ALDH1A1 P00352 4/20 0.35
TSHR P16473 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
PIM1 P11309 1/20 0.35

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
SCHEMBL6967175 0.88 KDM4E (0.38) MAPTSMN1; SMN2TACR3PDE3BPDE3A
SCHEMBL6963927 0.87 ABCG2 (0.45) ABCG2MAPTSMN1; SMN2HTR7ALDH1A1
SCHEMBL6955333 0.87 POLB (0.42) MAPTSMN1; SMN2TACR3PDE3BPDE3A
SCHEMBL6959295 0.87 MEN1 (0.42) ABCG2MAPTSMN1; SMN2TACR3PDE3B
SCHEMBL6952935 0.85 MAP4K1 (0.41) TACR3PDE3BPDE3AHTR7ALDH1A1
SCHEMBL6966887 0.85 KIT (0.47) ABCG2MAPTSMN1; SMN2HTR7ALDH1A1
SCHEMBL6961941 0.83 MAPT (0.42) ABCG2MAPTSMN1; SMN2TACR3PDE3B
SCHEMBL6966641 0.81 TP53 (0.41) MAPTSMN1; SMN2HTR7ALDH1A1NPC1
SCHEMBL6961528 0.81 HTR7 (0.48) MAPTHTR7ALDH1A1RAB9AHPGD
SCHEMBL6956631 0.79 MAPT (0.44) MAPTSMN1; SMN2ALDH1A1TSHRNPC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0955293-B1 UREA DERIVATIVES BANYU PHARMA CO LTD (JP) 2003-03-19 EP claimed