SCHEMBL3398423

SCHEMBL3398423

Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CCN(C2CCCC2)CC1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.60
MEN1 O00255 2/20 0.53
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 3/20 0.52
POLB P06746 2/20 0.52
RECQL P46063 1/20 0.48
MAPT P10636 2/20 0.48
RAB9A P51151 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
PDE4D Q08499 1/20 0.48
LMNA P02545 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TSHR P16473 1/20 0.47
ALOX12 P18054 1/20 0.47
P2RX7 Q99572 1/20 0.47
HPGD P15428 1/20 0.46

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
SCHEMBL3405473 0.86 KDM4E (0.47) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL2200588 0.85 KMT2A (0.51) KMT2AMEN1ALDH1A1POLBNPSR1
SCHEMBL2200244 0.83 KMT2A (0.55) KMT2AMEN1POLBMAPTRAB9A
SCHEMBL3403915 0.82 KMT2A (0.48) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL2200597 0.81 KMT2A (0.46) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL2200600 0.81 KMT2A (0.46) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL3402331 0.80 KMT2A (0.64) KMT2AMEN1ALDH1A1POLBMAPT
SCHEMBL3400876 0.79 LMNA (0.48) KMT2AMEN1KDM4EALDH1A1RAB9A
SCHEMBL2202742 0.79 KMT2A (0.50) KMT2AMEN1KDM4EALDH1A1
SCHEMBL13973728 0.78 ALDH1A1 (0.39) KMT2AMEN1KDM4EALDH1A1POLB

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-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed