SCHEMBL11540796

SCHEMBL11540796

Cc1nnsc1C(=O)N1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
KDM4E B2RXH2 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
RAB9A P51151 1/20 0.50
GFER P55789 1/20 0.50
MAPT P10636 1/20 0.49
POLB P06746 2/20 0.48
HPGD P15428 6/20 0.46
HTR2C P28335 1/20 0.42
MAPK1 P28482 1/20 0.41

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
SCHEMBL11536904 0.98 RAB9A (0.51) ALDH1A1KDM4EL3MBTL1RAB9AGFER
SCHEMBL11542984 0.83 CNR1 (0.49) ALDH1A1KDM4EL3MBTL1RAB9AGFER
SCHEMBL4820510 0.78 MAPT (0.43) ALDH1A1KDM4EL3MBTL1RAB9AGFER
SCHEMBL4820519 0.78 MAPT (0.43) ALDH1A1KDM4EL3MBTL1RAB9AGFER
SCHEMBL4429571 0.77 RAB9A (0.44) ALDH1A1KDM4EL3MBTL1RAB9AGFER
SCHEMBL11536023 0.76 LMNA (0.47) ALDH1A1KDM4EMAPTPOLB
SCHEMBL3319619 0.74 MAPT (0.46) ALDH1A1KDM4EL3MBTL1RAB9AGFER
SCHEMBL3454926 0.72 ALDH1A1 (0.59) ALDH1A1KDM4EL3MBTL1RAB9AMAPT
SCHEMBL29944007 0.72 ALDH1A1 (0.59) ALDH1A1KDM4EL3MBTL1RAB9AMAPT
SCHEMBL3768886 0.72 POLB (0.50) ALDH1A1KDM4EL3MBTL1RAB9AGFER

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-4177054-A PREEMERGENT AND POSTEMERGENT SCHERING AKTIENGESELLSCHAFT (DE) 1979-12-04 US claimed