SCHEMBL5167524

SCHEMBL5167524

CC(N)(CO)CCc1ccc(C(=O)CCCCOc2ccccc2)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 2/20 0.43
S1PR1 P21453 2/20 0.43
S1PR3 Q99500 2/20 0.43
TDP1 Q9NUW8 2/20 0.41
POLB P06746 1/20 0.41
S1PR5 Q9H228 1/20 0.41
HDAC1 Q13547 7/20 0.41
HDAC2 Q92769 7/20 0.41
PPARA Q07869 1/20 0.39
HDAC3 O15379 4/20 0.38
HDAC4 P56524 4/20 0.38
HDAC7 Q8WUI4 4/20 0.38
HDAC10 Q969S8 4/20 0.38
HDAC11 Q96DB2 4/20 0.38
HDAC8 Q9BY41 4/20 0.38
HDAC6 Q9UBN7 4/20 0.38
HDAC9 Q9UKV0 4/20 0.38
HDAC5 Q9UQL6 4/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL5165561 0.97 S1PR4 (0.41) S1PR4S1PR1S1PR3TDP1POLB
SCHEMBL5167474 0.93 TDP1 (0.40) S1PR4S1PR1S1PR3TDP1POLB
SCHEMBL5167475 0.87 MAPT (0.40) S1PR4S1PR1S1PR3TDP1POLB
SCHEMBL5169702 0.87 S1PR1 (0.40) S1PR4S1PR1S1PR3TDP1POLB
SCHEMBL385567 0.87 S1PR4 (0.53) S1PR4S1PR1S1PR3TDP1POLB
SCHEMBL5167727 0.86 S1PR1 (0.40) S1PR4S1PR1S1PR3TDP1POLB
SCHEMBL5166829 0.86 PPARA (0.40) S1PR4S1PR1S1PR3TDP1POLB
SCHEMBL385927 0.86 S1PR1 (0.53) S1PR4S1PR1S1PR3S1PR5
SCHEMBL5166095 0.85 MTNR1A (0.39) TDP1POLBALDH1A1LMNA
SCHEMBL5169594 0.85 SMN1; SMN2 (0.43) POLBALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1300405-B1 AMINO ALCOHOL DERIVATIVES SANKYO CO (JP) 2007-04-18 EP claimed
EP-1300405-A1 AMINO ALCOHOL DERIVATIVES Sankyo Company, Limited (JP) 2003-04-09 EP claimed
EP-1300405-B1 AMINO ALCOHOL DERIVATIVES SANKYO CO (JP) 2007-04-18 EP disclosed
US-6964976-B2 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2005-11-15 US disclosed
US-20040132784-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-08 US disclosed
US-6723745-B2 PREVENTION OR TREATMENT OF AUTOIMMUNE DISEASE IN WARM BLOODED ANIMAL SANKYO COMPANY, LIMITED (JP) 2004-04-20 US disclosed
US-20030236297-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2003-12-25 US disclosed
EP-1300405-A1 AMINO ALCOHOL DERIVATIVES Sankyo Company, Limited (JP) 2003-04-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030236297-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A S1PR4 2494/4885S1PR1 1542/4885S1PR3 1921/4885
US-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A S1PR4 2494/4885S1PR1 1542/4885S1PR3 1921/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.