SCHEMBL8849142

SCHEMBL8849142

CC(=CC(=CC1CC(C)(C)N(Cc2ccccc2)C(C)(C)C1)C(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.39
TMEM97 Q5BJF2 2/20 0.38
SIGMAR1 Q99720 2/20 0.38
AMPD2 Q01433 2/20 0.38
LMNA P02545 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CHRM2 P08172 1/20 0.36
CHRM3 P20309 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP3A4 P08684 2/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP2D6 P10635 1/20 0.34
ACHE P22303 1/20 0.33

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
SCHEMBL26919000 0.78 GAA (0.41) SIGMAR1AMPD2LMNAMEN1KMT2A
SCHEMBL8849043 0.78
SCHEMBL8849245 0.76 TSHR (0.30)
Acetic Acid SCHEMBL9813576 0.74 AMPD2 (0.47) TMEM97SIGMAR1AMPD2LMNAMEN1
SCHEMBL6904601 0.73 DRD2 (0.39) TMEM97SIGMAR1AMPD2LMNAMEN1
SCHEMBL995046 0.73 DRD2 (0.39) TMEM97SIGMAR1AMPD2LMNAMEN1
SCHEMBL909995 0.72 AMPD2 (0.43) TMEM97SIGMAR1AMPD2MEN1KMT2A
SCHEMBL909996 0.72 AMPD2 (0.43) TMEM97SIGMAR1AMPD2MEN1KMT2A
SCHEMBL11841166 0.71 TSHR (0.43) TMEM97SIGMAR1AMPD2MEN1KMT2A
SCHEMBL39509 0.70 KMT2A (0.44) SIGMAR1AMPD2MEN1KMT2ACHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0499581-B1 Stabilized polymer composition CIBA GEIGY AG (CH) 1997-07-09 EP disclosed
EP-0479725-B1 Stabilized styrene copolymers containing elastomer particles CIBA GEIGY AG (CH) 1995-04-26 EP disclosed
EP-0337431-B1 STABILIZED STYRENE COPOLYMER COMPRISING ELASTOMER PARTICLES CIBA-GEIGY AG (CH) 1993-06-23 EP disclosed
EP-0499581-A1 Stabilized polymer composition CIBA-GEIGY AG (CH) 1992-08-19 EP disclosed
EP-0479725-A2 Stabilized styrene copolymers containing elastomer particles CIBA-GEIGY AG (CH) 1992-04-08 EP disclosed
EP-0337431-A2 Stabilized styrene copolymer comprising elastomer particles CIBA-GEIGY AG (CH) 1989-10-18 EP disclosed