SCHEMBL10409265

SCHEMBL10409265

CC(C)Cc1cc(Br)ccc1N

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
GLA P06280 1/20 0.37
GABRA1 P14867 2/20 0.36
GABRB2 P47870 2/20 0.36
MAPT P10636 3/20 0.35
DPP4 P27487 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
AAK1 Q2M2I8 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL31310646 0.85 KDM4E (0.39) KDM4EGLAMAPTSLC6A2SLC6A4
SCHEMBL12320858 0.84 GABRA1 (0.36) KDM4EGLAGABRA1GABRB2MAPT
SCHEMBL19410653 0.83 AAK1 (0.38) KDM4EGLAMAPTSLC6A2SLC6A4
SCHEMBL2262110 0.79 KDM4E (0.34) KDM4EGLAMAPTSLC6A2SLC6A4
SCHEMBL2339661 0.79 MAPT (0.41) KDM4EGABRA1GABRB2MAPTALDH1A1
SCHEMBL30227313 0.79 MAPT (0.41) KDM4EGABRA1GABRB2MAPTALDH1A1
SCHEMBL9069659 0.79 ALDH1A1 (0.43) KDM4EGABRA1GABRB2MAPTMEN1
SCHEMBL12204983 0.79 ALOX15 (0.39) GABRA1GABRB2MAPTDPP4
Ammonia Solution, Strong SCHEMBL20529675 0.78 KDM4E (0.36) KDM4EGLAMAPTDPP4SLC6A2
SCHEMBL22715284 0.78 DPP4 (0.40) GABRA1GABRB2MAPTDPP4ALDH1A1

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-4925984-A REACTION WITH BROMINE IN SOLUTION ETHYL CORPORATION (US) 1990-05-15 US disclosed