SCHEMBL6176380

SCHEMBL6176380

CCS(=O)(=O)N(c1cc(-c2ncc(C(F)(F)F)cc2Cl)ccc1C#N)S(=O)(=O)CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
KDM4E B2RXH2 3/20 0.46
SMN1; SMN2 Q16637 4/20 0.41
POLB P06746 2/20 0.41
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
HTT P42858 3/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
PKM P14618 2/20 0.38
LMNA P02545 4/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
GCK P35557 1/20 0.36
GCKR Q14397 1/20 0.36
RECQL P46063 1/20 0.35

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
SCHEMBL6177660 0.80 ALDH1A1 (0.46) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6175393 0.76 ALDH1A1 (0.48) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6176491 0.76 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL8545370 0.76 ALDH1A1 (0.55) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL8548969 0.75 ALDH1A1 (0.52) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL8546136 0.73 ALDH1A1 (0.46) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6176381 0.73 ALDH1A1 (0.50) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL9034255 0.70 ALDH1A1 (0.52) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6177968 0.69 ALDH1A1 (0.53) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL27460628 0.69 ALDH1A1 (0.43) ALDH1A1KDM4ESMN1; SMN2POLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708756-B1 SUBSTITUTED 2-PHENYLPYRIDINES WITH HERBICIDAL ACTION BASF AG (DE) 2005-06-01 EP disclosed
US-5783522-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-07-21 US disclosed
CN-1127504-A Substituted 2-phenylpyridines with herbicidal action BASF AG (DE) 1996-07-24 CN disclosed
EP-0708756-A1 SUBSTITUTED 2-PHENYLPYRIDINES WITH HERBICIDAL ACTION BASF AKTIENGESELLSCHAFT (DE) 1996-05-01 EP disclosed
WO-1995002580-A2 SUBSTITUTED 2-PHENYLPYRIDINES WITH HERBICIDAL ACTION BASF AKTIENGESELLSCHAFT (DE) 1995-01-26 WO disclosed