SCHEMBL7977092

SCHEMBL7977092

[NH]C(=O)CCc1nc(Cc2ccccc2)no1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
TSHR P16473 1/20 0.49
ALDH1A1 P00352 6/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GLA P06280 1/20 0.47
CHUK O15111 1/20 0.46
TXNRD1 Q16881 1/20 0.46
NOX4 Q9NPH5 1/20 0.46
MAPT P10636 2/20 0.46
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
HDAC6 Q9UBN7 1/20 0.43
HTR1A P08908 1/20 0.43
HTR2C P28335 1/20 0.43
KMT2A Q03164 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43

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
SCHEMBL563400 0.88 TSHR (0.51) MAPK1TDP1TSHRALDH1A1L3MBTL1
SCHEMBL7977094 0.86 MAPK1 (0.49) MAPK1TDP1TSHRALDH1A1L3MBTL1
SCHEMBL1713562 0.82 CYP1A2 (0.50) MAPK1TDP1TSHRALDH1A1L3MBTL1
SCHEMBL562969 0.82 LMNA (0.46) MAPK1TDP1TSHRALDH1A1L3MBTL1
SCHEMBL11553918 0.79 MAPK1 (0.54) MAPK1TDP1TSHRALDH1A1L3MBTL1
SCHEMBL835436 0.78 MAPK1 (0.52) MAPK1TDP1TSHRALDH1A1L3MBTL1
SCHEMBL10264767 0.77 MAPK1 (0.55) MAPK1TDP1TSHRALDH1A1L3MBTL1
SCHEMBL6528316 0.77 MAPK1 (0.57) MAPK1TDP1TSHRALDH1A1L3MBTL1
SCHEMBL7977105 0.77 ALDH1A1 (0.69) TSHRALDH1A1L3MBTL1MAPTCYP1A2
SCHEMBL3105661 0.75 MAPK1 (0.50) MAPK1TDP1TSHRALDH1A1L3MBTL1

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
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed