SCHEMBL9356347

SCHEMBL9356347

Cc1cccc(C)c1C(=O)CCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.52
KMT2A Q03164 4/20 0.52
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 2/20 0.47
GAA P10253 1/20 0.47
CYP2C19 P33261 1/20 0.47
FFAR1 O14842 3/20 0.46
CYP1A2 P05177 2/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
HTT P42858 1/20 0.45
TSHR P16473 1/20 0.44
USP5 P45974 1/20 0.43
GFER P55789 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
POLB P06746 1/20 0.42
CYP2D6 P10635 1/20 0.42

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
SCHEMBL8215067 0.79 KMT2A (0.55) NR4A2KMT2AMEN1ALDH1A1GAA
SCHEMBL5994212 0.79 F2R (0.38) KMT2AMEN1ALDH1A1CYP2C19CYP1A2
SCHEMBL27592409 0.79 F2R (0.38) KMT2AMEN1ALDH1A1CYP2C19CYP1A2
P-Xylene SCHEMBL8112572 0.79 KMT2A (0.61) NR4A2KMT2AMEN1ALDH1A1FFAR1
SCHEMBL7475817 0.79 KMT2A (0.54) NR4A2KMT2AMEN1ALDH1A1GAA
SCHEMBL29541385 0.78 KMT2A (0.62) NR4A2KMT2AMEN1ALDH1A1GAA
SCHEMBL828846 0.78 KMT2A (0.62) NR4A2KMT2AMEN1ALDH1A1GAA
SCHEMBL11702836 0.77 ALDH1A1 (0.56) NR4A2KMT2AMEN1ALDH1A1GAA
SCHEMBL4091513 0.76 KMT2A (0.47) NR4A2KMT2AMEN1ALDH1A1GAA
SCHEMBL1275962 0.76 MEN1 (0.66) KMT2AMEN1ALDH1A1FFAR1HTT

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
EP-0412933-B1 Coating compositions CIBA GEIGY AG (CH) 1994-09-14 EP disclosed
US-5183842-A Mixture of ketoacid and amine with film-forming binder, curing CIBA-GEIGY CORPORATION (US) 1993-02-02 US disclosed
US-5128396-A Corrosion inhibiting primers on metallic substrates CIBA-GEIGY CORPORATION (US) 1992-07-07 US disclosed
EP-0412933-A1 Coating compositions CIBA-GEIGY AG (CH) 1991-02-13 EP disclosed