SCHEMBL9755930

SCHEMBL9755930

COC(=O)Cc1c[nH]c2c(Cl)cc(Cl)c(Cl)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.48
CSNK2B P67870 1/20 0.48
CSNK2A1 P68400 1/20 0.48
LMNA P02545 3/20 0.39
HSP90AB1 P08238 1/20 0.36
NR4A2 P43354 1/20 0.35
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 2/20 0.34
MAPT P10636 1/20 0.34
MTNR1A P48039 4/20 0.34
MTNR1B P49286 4/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
NFKB1 P19838 1/20 0.34
MAPK1 P28482 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
SCHEMBL9755991 0.81 CSNK2A2 (0.56) CSNK2A2CSNK2BCSNK2A1LMNAALDH1A1
SCHEMBL1163334 0.79 GAA (0.33) CSNK2A2CSNK2BCSNK2A1LMNAHSP90AB1
SCHEMBL9756250 0.77 NR4A2 (0.43) LMNANR4A2ALDH1A1SMN1; SMN2MEN1
SCHEMBL9937273 0.72 LRRK2 (0.47) CSNK2A1LMNANR4A2ALDH1A1SMN1; SMN2
SCHEMBL152993 0.72 NR4A2 (0.59) LMNANR4A2ALDH1A1SMN1; SMN2MEN1
SCHEMBL5487981 0.72 LMNA (0.53) LMNAHSP90AB1ALDH1A1SMN1; SMN2MEN1
SCHEMBL7128332 0.72 MTNR1A (0.51) LMNANR4A2ALDH1A1SMN1; SMN2MEN1
SCHEMBL27697644 0.71 MTNR1A (0.34) LMNAALDH1A1GAAMAPTMTNR1A
SCHEMBL27554482 0.70 NR4A2 (0.41) LMNANR4A2ALDH1A1SMN1; SMN2MEN1
SCHEMBL27531827 0.70 GPR17 (0.42) LMNANR4A2ALDH1A1SMN1; SMN2MEN1

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-0256128-B1 INDOLEACETIC ACID DERIVATIVES AND USE THEREOF AS PLANT GROWTH REGULATORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1991-11-06 EP disclosed
US-4806143-A Indoleacetic acid derivatives and application thereof as plant growth regulators NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1989-02-21 US disclosed
EP-0256128-A1 INDOLEACETIC ACID DERIVATIVES AND USE THEREOF AS PLANT GROWTH REGULATORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1988-02-24 EP disclosed