SCHEMBL9765210

SCHEMBL9765210

CCOC(=O)CSC(=O)c1cc(N2C(=O)C3=C(CCCC3)C2=O)ccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 2/20 0.38
LMNA P02545 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
PLA2G1B P04054 1/20 0.38
POLB P06746 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
HTT P42858 2/20 0.36
MAPK1 P28482 1/20 0.36
HPGD P15428 2/20 0.36
PARP1 P09874 1/20 0.36
CASP3 P42574 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
CYP2C19 P33261 1/20 0.35
KDM4E B2RXH2 1/20 0.34
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
SCHEMBL9765180 0.90 ALDH1A1 (0.35) KMT2AMAPTALDH1A1MEN1SMN1; SMN2
SCHEMBL9765536 0.90 KMT2A (0.37) KMT2AMAPTALDH1A1MEN1LMNA
SCHEMBL9765223 0.89 MEN1 (0.40) KMT2AMAPTALDH1A1MEN1LMNA
SCHEMBL9765167 0.89 MEN1 (0.35) KMT2AMAPTALDH1A1MEN1LMNA
SCHEMBL9765169 0.87 SLC6A2 (0.37) KMT2AMAPTALDH1A1MEN1LMNA
SCHEMBL9765218 0.83 KMT2A (0.38) KMT2AMAPTALDH1A1MEN1LMNA
SCHEMBL9765187 0.83 SLC6A3 (0.41) KMT2AMAPTALDH1A1MEN1LMNA
SCHEMBL9765184 0.82 PPOX (0.44)
SCHEMBL9765212 0.81 MEN1 (0.39) KMT2AMAPTALDH1A1MEN1LMNA
SCHEMBL9765221 0.80 ALDH1A1 (0.39) KMT2AMAPTALDH1A1MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0233151-B1 ESTERS AS HERBICIDES CIBA-GEIGY AG (CH) 1991-11-13 EP claimed
US-5034048-A Plant growth regulators, 5(tetrahydrophthalamido)benzoic acid derivatives for controlling weeds CIBA-GEIGY CORPORATION (US) 1991-07-23 US disclosed
US-4917721-A TETRAHYDROPHTHALIMIDO BENZOIC ACID THIOESTERS CIBA-GEIGY CORPORATION (US) 1990-04-17 US disclosed