SCHEMBL11014233

SCHEMBL11014233

CC(=O)c1ncccc1-c1cc(C)no1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
TSHR P16473 2/20 0.55
USP2 O75604 1/20 0.55
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.45
MAPK1 P28482 1/20 0.45
EGLN2 Q96KS0 1/20 0.44
BRD4 O60885 1/20 0.44
POLB P06746 2/20 0.43
ALOX12 P18054 1/20 0.41
HCRTR1 O43613 2/20 0.39
HCRTR2 O43614 2/20 0.39
NPC1 O15118 1/20 0.39
NTRK1 P04629 1/20 0.38
ADRA1A P35348 1/20 0.38
ADRA1B P35368 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
GLA P06280 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL3395281 0.76 ALDH1A1 (0.55) KDM4EALDH1A1TSHRUSP2KMT2A
SCHEMBL16807565 0.73 ELANE (0.46) KDM4ETSHRMAPK1HCRTR1HCRTR2
SCHEMBL17449213 0.72 ALDH1A1 (0.44) KDM4EALDH1A1TSHRKMT2AMEN1
SCHEMBL31278612 0.72 ALDH1A1 (0.44) KDM4EALDH1A1TSHRKMT2AMEN1
SCHEMBL2543684 0.71 ALDH1A1 (0.45) KDM4EALDH1A1TSHRUSP2KMT2A
SCHEMBL9955618 0.70 ALDH1A1 (0.57) KDM4EALDH1A1TSHRUSP2KMT2A
SCHEMBL29601706 0.69 KDM4E (0.46) KDM4EALDH1A1TSHRKMT2AMEN1
SCHEMBL5649730 0.69 RAB9A (0.66) KDM4EALDH1A1TSHRUSP2KMT2A
SCHEMBL6902624 0.69 KDM4E (0.46) KDM4EALDH1A1TSHRKMT2AMEN1
SCHEMBL2487359 0.69 ALDH1A1 (0.56) KDM4EALDH1A1TSHRUSP2KMT2A

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-0159640-A1 4-Methoxy-2,2'-bipyridyl-6-aldoximes, process and intermediates for their preparation and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1985-10-30 EP disclosed