SCHEMBL9801530

SCHEMBL9801530

CCCCNC1(O)CCCC1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
EPHX1 P07099 2/20 0.31
ALOX15 P16050 1/20 0.31
ADH1B P00325 1/20 0.30
ADH1C P00326 1/20 0.30
ADH1A P07327 1/20 0.30
ADH7 P40394 1/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL9801614 0.98 TSHR (0.32) TSHRMEN1KMT2AEPHX1ALOX15
SCHEMBL9801202 0.98 TSHR (0.32) TSHRMEN1KMT2AEPHX1ALOX15
SCHEMBL9801454 0.93 ALDH1A1 (0.39) TSHREPHX1
SCHEMBL9802040 0.91 GBA1 (0.39) TSHREPHX1
SCHEMBL9801483 0.91 ALDH1A1 (0.37) TSHREPHX1
SCHEMBL9801055 0.91 GBA1 (0.39) TSHREPHX1
SCHEMBL9801375 0.91 GBA1 (0.39) TSHREPHX1
SCHEMBL9801870 0.91 GBA1 (0.39) TSHREPHX1
SCHEMBL9801027 0.91 GBA1 (0.39) TSHREPHX1
SCHEMBL9801668 0.91 GBA1 (0.39) TSHREPHX1

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-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed