SCHEMBL9350606

SCHEMBL9350606

CC(C)CP(CC(C)C)Oc1ccc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 3/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
CYP2C19 P33261 2/20 0.33
APEX1 P27695 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
POLB P06746 1/20 0.31
ALDH1A1 P00352 2/20 0.31
RECQL P46063 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL9346988 0.82 KDM4E (0.37) ATML3MBTL1KDM4ECA1CA2
SCHEMBL9347250 0.79 KDM4E (0.36) ATML3MBTL1KDM4ECA1CA2
SCHEMBL7613158 0.79 CA1 (0.37) ATML3MBTL1KDM4ECA1CA2
SCHEMBL7607426 0.79 CA1 (0.37) ATML3MBTL1KDM4ECA1CA2
SCHEMBL9347275 0.78 KDM4E (0.35) ATML3MBTL1KDM4ESCN10AALDH1A1
SCHEMBL26607 0.78 CA1 (0.41) ATML3MBTL1KDM4ECA1CA2
SCHEMBL29349873 0.78 CA1 (0.41) ATML3MBTL1KDM4ECA1CA2
SCHEMBL9347011 0.78 CA1 (0.41) ATML3MBTL1KDM4ECA1CA2
SCHEMBL9347000 0.77 ATM (0.36) ATML3MBTL1KDM4ECA1CA2
SCHEMBL9347279 0.77 PGR (0.35) ATML3MBTL1KDM4ECA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5298644-A Aryl phosphinites HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-29 US disclosed