SCHEMBL11241802

SCHEMBL11241802

CC(C)(C)[C](O)C(c1ccccc1)C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SLC6A4 P31645 3/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A3 Q01959 2/20 0.40
RIPK1 Q13546 2/20 0.39
AOC3 Q16853 2/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ADRA2A P08913 1/20 0.35
ADRA2C P18825 1/20 0.35
HIF1A Q16665 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP2D6 P10635 1/20 0.34
SRC P12931 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL21747696 0.79 ATM (0.53) ATML3MBTL1SLC6A4SLC6A2SLC6A3
SCHEMBL1706949 0.78 ATM (0.58) ATML3MBTL1LMNAMEN1KMT2A
SCHEMBL1703642 0.78 ATM (0.58) ATML3MBTL1LMNAMEN1KMT2A
SCHEMBL17357501 0.77 L3MBTL1 (0.61) ATML3MBTL1SLC6A4SLC6A2SLC6A3
SCHEMBL9637953 0.77 ATM (0.52) ATML3MBTL1SLC6A4SLC6A2SLC6A3
SCHEMBL66018 0.77 L3MBTL1 (0.61) ATML3MBTL1SLC6A4SLC6A2SLC6A3
SCHEMBL2416799 0.76 ATM (0.59) ATML3MBTL1SLC6A4SLC6A2SLC6A3
SCHEMBL8975800 0.76 L3MBTL1 (0.59) ATML3MBTL1SLC6A4SLC6A2SLC6A3
SCHEMBL8870520 0.74 L3MBTL1 (0.58) ATML3MBTL1SLC6A4SLC6A2SLC6A3
SCHEMBL10389938 0.74 L3MBTL1 (0.58) ATML3MBTL1SLC6A4SLC6A2SLC6A3

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
US-RE31002-E N-(3-Hydroxyaryl-propyl)-imides CIBA-GEIGY CORPORATION (US) 1982-07-27 US disclosed
US-4066616-A ORGANIC POLYMERS CIBA-GEIGY CORPORATION (US) 1978-01-03 US disclosed
US-3956298-A POLYMER STABILIZERS CIBA-GEIGY CORPORATION (US) 1976-05-11 US disclosed