SCHEMBL7930198

SCHEMBL7930198

CCn1c(SCC(=O)Nc2ccc(Cl)cc2)nc2ccccc21

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.78
MEN1 O00255 2/20 0.78
KMT2A Q03164 2/20 0.78
HTT P42858 2/20 0.78
NPC1 O15118 1/20 0.78
RAB9A P51151 1/20 0.78
SMN1; SMN2 Q16637 1/20 0.78
LMNA P02545 7/20 0.67
ALDH1A1 P00352 3/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
TP53 P04637 5/20 0.66
POLB P06746 4/20 0.66
GLA P06280 1/20 0.59

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
SCHEMBL13623622 0.77 LMNA (0.67) MAPTMEN1KMT2AHTTNPC1
SCHEMBL2607501 0.75 GSK3B (0.69) MAPTMEN1KMT2AHTTSMN1; SMN2
SCHEMBL13623674 0.75 ALDH1A1 (0.80) MAPTMEN1KMT2AHTTNPC1
SCHEMBL4213595 0.74 MAPK1 (0.62) MAPTKMT2ALMNAALDH1A1TP53
SCHEMBL15986284 0.72 ALDH1A1 (1.00) MAPTALDH1A1L3MBTL1POLB
SCHEMBL4209713 0.72 ALDH1A1 (0.79) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL4203450 0.72 ALDH1A1 (0.68) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL10175827 0.72 KMT2A (0.70) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL12487210 0.72 MPO (0.78) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL3367359 0.72 KMT2A (0.61) MAPTMEN1KMT2ASMN1; SMN2LMNA

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
US-6245817-B1 NEUROPEPTIDE Y BAYER CORPORATION 2001-06-12 US claimed