SCHEMBL27694697

SCHEMBL27694697

NOC(=O)CCCCCC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.60
LMNA P02545 3/20 0.60
NFKB1 P19838 2/20 0.60
PMP22 Q01453 1/20 0.60
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 2/20 0.54
ALOX15 P16050 2/20 0.54
KMT2A Q03164 2/20 0.54
PLG P00747 1/20 0.54
THRB P10828 1/20 0.54
SLC6A2 P23975 1/20 0.54
RECQL P46063 1/20 0.54
SLC6A3 Q01959 1/20 0.54
GPR84 Q9NQS5 7/20 0.50
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 2/20 0.50
CYP2D6 P10635 1/20 0.50
PPARG P37231 6/20 0.48
PPARD Q03181 6/20 0.48
PPARA Q07869 6/20 0.48

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
SCHEMBL11480082 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL18383745 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL17011633 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL13115062 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL11486379 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22ALDH1A1
Adipic Acid SCHEMBL810759 0.97 LMNA (0.58) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL458277 0.97 LMNA (0.58) TSHRLMNANFKB1PMP22ALDH1A1
Adipic Acid SCHEMBL28333156 0.95 TSHR (0.56) TSHRLMNANFKB1PMP22ALDH1A1
Ammonia Solution, Strong SCHEMBL28253015 0.95 LMNA (0.55) TSHRLMNANFKB1PMP22ALDH1A1
Bicarbonate SCHEMBL14856388 0.95 LMNA (0.55) TSHRLMNANFKB1PMP22ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101092372-A Method for practical synthesizing optically active alpha amino pimelic acid ester or monoester YAOMINGKANGDE NEW MEDICINES DE (CN) 2007-12-26 CN claimed
CN-101092372-B Method for practical synthesizing optically active alpha amino pimelic acid ester or monoester YAOMINGKANGDE NEW MEDICINES DEV CO LTD SHANGHAI 2011-09-21 CN disclosed
CN-101092372-B Method for practical synthesizing optically active alpha amino pimelic acid ester or monoester YAOMINGKANGDE NEW MEDICINES DEV CO LTD SHANGHAI 2011-09-21 CN disclosed
CN-101092372-A Method for practical synthesizing optically active alpha amino pimelic acid ester or monoester YAOMINGKANGDE NEW MEDICINES DE (CN) 2007-12-26 CN disclosed
CN-101092372-A Method for practical synthesizing optically active alpha amino pimelic acid ester or monoester YAOMINGKANGDE NEW MEDICINES DE (CN) 2007-12-26 CN disclosed