SCHEMBL21021958

SCHEMBL21021958

Cc1cc(C#N)cc(C2C(C(=O)O)C2(Cl)Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.40
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 1/20 0.38
RECQL P46063 1/20 0.38
HTT P42858 4/20 0.37
LMNA P02545 2/20 0.37
HPGD P15428 1/20 0.37
MAPT P10636 2/20 0.32
MAPK1 P28482 1/20 0.32
MGLL Q99685 1/20 0.32
GPR35 Q9HC97 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL18143894 0.84 SLC9A1 (0.37) MEN1KMT2AALDH1A1RECQLHTT
SCHEMBL18143898 0.84 SLC9A1 (0.37) MEN1KMT2AALDH1A1RECQLHTT
SCHEMBL18143896 0.84 SLC9A1 (0.37) MEN1KMT2AALDH1A1RECQLHTT
SCHEMBL18144068 0.79 MEN1 (0.44) FFAR4MEN1KMT2AALDH1A1RECQL
SCHEMBL21022280 0.79 FFAR4 (0.36) FFAR4ALDH1A1
SCHEMBL18144069 0.79 MEN1 (0.44) FFAR4MEN1KMT2AALDH1A1RECQL
SCHEMBL21018775 0.79 MEN1 (0.44) FFAR4MEN1KMT2AALDH1A1RECQL
SCHEMBL21586978 0.79 MEN1 (0.44) FFAR4MEN1KMT2AALDH1A1RECQL
SCHEMBL18144070 0.79 MEN1 (0.44) FFAR4MEN1KMT2AALDH1A1RECQL
SCHEMBL23466013 0.74 FFAR4 (0.40) FFAR4MEN1KMT2AALDH1A1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3578541-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITION, AND PROCESSES, RELATED THERETO Dow AgroSciences LLC (US) 2019-12-11 EP disclosed
EP-3283460-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITION, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed