SCHEMBL28518183

SCHEMBL28518183

Cc1ccc(N)c(CC(O)CCCO)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
THRB P10828 1/20 0.37
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 1/20 0.34
TAAR1 Q96RJ0 1/20 0.32
KCNH2 Q12809 2/20 0.31
ATP4A P20648 1/20 0.30
ATP4B P51164 1/20 0.30
AMY1A P0DUB6 1/20 0.30
TSHR P16473 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
CA1 P00915 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
SCHEMBL5147480 0.83 ALOX15 (0.42) ALOX15TDP1SMN1; SMN2TP53CYP3A4
SCHEMBL33610 0.78 ALOX15 (0.46) ALOX15TDP1SMN1; SMN2TP53CYP3A4
SCHEMBL28151426 0.78 CSNK2A1 (0.39) ALDH1A1CA1
SCHEMBL6369444 0.76 ALOX15 (0.45) ALOX15TDP1SMN1; SMN2TP53CYP3A4
SCHEMBL19526504 0.76 ALOX15 (0.45) ALOX15TDP1SMN1; SMN2TP53CYP3A4
SCHEMBL27672527 0.76 TDP1 (0.41) ALOX15TDP1SMN1; SMN2TP53CYP3A4
SCHEMBL1173554 0.72 ALOX15 (0.48) ALOX15TDP1SMN1; SMN2TP53CYP3A4
SCHEMBL356244 0.72 ALOX15 (0.52) ALOX15TDP1SMN1; SMN2TP53CYP3A4
SCHEMBL17063467 0.71 TSHR (0.36) ALOX15TDP1SMN1; SMN2TP53CYP3A4
Hydrochloric Acid SCHEMBL7394868 0.69 TDP1 (0.45) ALOX15TDP1SMN1; SMN2TP53CYP3A4

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
CN-113603393-A Fastening system with finely divided filler 费希尔厂有限责任两合公司 2021-11-05 CN disclosed
CN-112313187-A Phthalate-free kit-use for fixing anchoring elements in the construction field 费希尔厂有限责任两合公司 2021-02-02 CN disclosed