SCHEMBL13875007

SCHEMBL13875007

C=CCCNC(=O)C(C)(C)/N=N/C(C)(C)C(=O)NCCC=C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
CNR1 P21554 1/20 0.32
ABCC4 O15439 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL157277 0.80 SMN1; SMN2 (0.42) ALDH1A1LMNAMAPTKMT2A
SCHEMBL157278 0.80 SMN1; SMN2 (0.42) ALDH1A1LMNAMAPTKMT2A
SCHEMBL6888023 0.79 CNR1 (0.38) ALDH1A1CNR1MAPTKMT2A
SCHEMBL6888021 0.79 CNR1 (0.38) ALDH1A1CNR1MAPTKMT2A
SCHEMBL30003800 0.78 ALDH1A1 (0.34) ALDH1A1
SCHEMBL21870499 0.77 CNR1 (0.41) ALDH1A1CNR1MAPTKMT2A
SCHEMBL1156659 0.75 KDM4C (0.44) ALDH1A1CNR1KMT2A
SCHEMBL17732616 0.75 CNR1 (0.41) ALDH1A1CNR1MAPTKMT2A
SCHEMBL35559 0.75 CNR1 (0.41) ALDH1A1CNR1MAPTKMT2A
SCHEMBL1156662 0.75 KDM4C (0.44) ALDH1A1CNR1KMT2A

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-20090105097-A1 Degradable Friction Reducer SCHLUMBERGER TECHNOLOGY CORPORATION 2009-04-23 US disclosed