SCHEMBL8486307

SCHEMBL8486307

CC(C)(CO)C(=O)N1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.39
ATM Q13315 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL8485226 0.98 ALDH1A1 (0.41) RIPK1ATMMEN1KMT2ACYP1A2
SCHEMBL21551733 0.83 RIPK1 (0.36) RIPK1MEN1KMT2ACYP2C19ALDH1A1
SCHEMBL8486303 0.82 RIPK1 (0.39) RIPK1ATMMEN1KMT2ACYP1A2
SCHEMBL12335246 0.82 RIPK1 (0.54) RIPK1ATMMEN1KMT2ACYP1A2
SCHEMBL8193452 0.81 CA2 (0.42)
SCHEMBL8489683 0.81 SMN1; SMN2 (0.49) MEN1KMT2AALDH1A1L3MBTL1RAB9A
SCHEMBL3550200 0.81 RIPK1 (0.35) RIPK1
SCHEMBL8485223 0.80 ALDH1A1 (0.41) RIPK1ATMMEN1KMT2ACYP1A2
SCHEMBL13886361 0.80 RIPK1 (0.38) RIPK1ATMMEN1KMT2ACYP1A2
SCHEMBL949402 0.80 RIPK1 (0.38) RIPK1ATMMEN1KMT2ACYP1A2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5958837-A 2-(PHENYLMETHOXY OR CARBONYLOXY-(1,4-PHENYLENE)-),3-HALO,5-HALOALKYLPYRIDINES; HERBICIDES EFFECTING DESICCATION AND DEFOLIATION OF PLANTS; GOOD ACTIVITY AND BETTER TAILORED CONTROL OF WEEDS BASF AKTIENGESELLSCHAFT (DE) 1999-09-28 US disclosed
EP-0802904-B1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AG (DE) 1998-09-09 EP disclosed
EP-0802904-A1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-10-29 EP disclosed
WO-1996021647-A1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-07-18 WO disclosed