SCHEMBL7737858

SCHEMBL7737858

CCCCC[C]1CCCCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CCR5 P51681 3/20 0.40
HRH3 Q9Y5N1 1/20 0.39
CYP1A2 P05177 1/20 0.37
ESR1 P03372 2/20 0.37
ADRA2A P08913 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
TACR2 P21452 2/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
SHBG P04278 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
HSPD1 P10809 1/20 0.37
ADRB3 P13945 1/20 0.37

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
SCHEMBL7738576 1.00 MEN1 (0.42) MEN1KMT2ACCR5HRH3CYP1A2
SCHEMBL7733127 1.00 MEN1 (0.42) MEN1KMT2ACCR5HRH3CYP1A2
SCHEMBL677747 1.00 MEN1 (0.42) MEN1KMT2ACCR5HRH3CYP1A2
SCHEMBL7733439 1.00 MEN1 (0.42) MEN1KMT2ACCR5HRH3CYP1A2
SCHEMBL7739729 0.97 CCR5 (0.42) MEN1KMT2ACCR5HRH3ESR1
SCHEMBL7738487 0.97 CCR5 (0.42) MEN1KMT2ACCR5HRH3ESR1
SCHEMBL7739205 0.97 CCR5 (0.42) MEN1KMT2ACCR5HRH3ESR1
SCHEMBL11863354 0.97 CCR5 (0.42) MEN1KMT2ACCR5HRH3ESR1
SCHEMBL21114249 0.97 CCR5 (0.42) MEN1KMT2ACCR5HRH3ESR1
SCHEMBL734136 0.97 CCR5 (0.42) MEN1KMT2ACCR5HRH3ESR1

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-6410748-B1 Alicycli c group-containing monomer KABUSHIKI KAISHA TOSHIBA (JP) 2002-06-25 US disclosed
US-6291129-B1 LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS KABUSHIKI KAISHA TOSHIBA (JP) 2001-09-18 US disclosed