SCHEMBL15724624

SCHEMBL15724624

CCCCCCCCc1cc(Br)sc1-c1cc(CCCCCCCC)c(-c2ccc(-c3sc(-c4sc(Br)cc4CCCCCCCC)cc3CCCCCCCC)c3nsnc23)s1

nearest known ligand 0.31

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TYR P14679 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL15724560 0.94 — —
SCHEMBL12887132 0.94 MEN1 (0.30) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL15724621 0.94 TYR (0.34) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL2050071 0.94 TYR (0.34) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL15724628 0.91 — —
SCHEMBL12610266 0.90 — —
SCHEMBL12887104 0.86 MEN1 (0.31) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL12887115 0.86 MEN1 (0.31) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL12887123 0.86 MEN1 (0.31) MEN1TP53CYP3A4ALOX5MAPT
SCHEMBL15724626 0.85 MEN1 (0.30) MEN1TP53CYP3A4ALOX5MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9184315-B2 Photoelectric materials and preparation thereof NANKAI UNIVERSITY (CN) 2015-11-10 — — US disclosed
US-20140142308-A1 PHOTOELECTRIC MATERIALS AND PREPARATION THEREOF NANKAI UNIVERSITY (CN) 2014-05-22 — — US disclosed
Send feedback