SCHEMBL4851907

SCHEMBL4851907

COC(=O)CC(NC(=O)c1ccc(N2CCCCCC2)nc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
HPGD P15428 4/20 0.47
RAB9A P51151 5/20 0.46
NPC1 O15118 3/20 0.46
KMT2A Q03164 1/20 0.46
HPGDS O60760 2/20 0.45
MCHR1 Q99705 1/20 0.43
KDM4E B2RXH2 3/20 0.42
MAPK1 P28482 1/20 0.42
FOLH1 Q04609 1/20 0.42
TRPV1 Q8NER1 1/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
UBE2T Q9NPD8 1/20 0.41
POLB P06746 1/20 0.41
ALOX15 P16050 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL4848079 0.91 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2HPGDRAB9ANPC1
SCHEMBL4845407 0.86 HDAC1 (0.49) ALDH1A1SMN1; SMN2HPGDRAB9ANPC1
SCHEMBL4680782 0.78 LMNA (0.52) ALDH1A1SMN1; SMN2RAB9ANPC1KMT2A
SCHEMBL6183765 0.75 CTSL (0.59) ALDH1A1SMN1; SMN2HPGD
SCHEMBL7325011 0.74 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2HPGDRAB9ANPC1
SCHEMBL7326778 0.74 RAB9A (0.71) ALDH1A1SMN1; SMN2HPGDRAB9ANPC1
SCHEMBL6183960 0.74 CTSL (0.60) ALDH1A1SMN1; SMN2HPGD
SCHEMBL7325387 0.73 NPC1 (0.58) ALDH1A1SMN1; SMN2HPGDRAB9ANPC1
SCHEMBL30175325 0.73 UBE2T (0.56) ALDH1A1SMN1; SMN2HPGDRAB9ANPC1
SCHEMBL3895677 0.73 RAB9A (0.72) ALDH1A1SMN1; SMN2HPGDRAB9ANPC1

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
US-7323456-B2 Carboxylic acid derivatives compounds and agents comprising the compounds as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-01-29 US disclosed
US-7323456-B2 Carboxylic acid derivatives compounds and agents comprising the compounds as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-01-29 US disclosed
US-7323456-B2 Carboxylic acid derivatives compounds and agents comprising the compounds as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-01-29 US disclosed
US-20040254370-A1 Carboxylic acid derivatives compounds and agents comprising the compounds as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 US disclosed
EP-1445256-A1 CARBOXYLIC ACID DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-08-11 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 (1 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-20040254370-A1 Carboxylic acid derivatives compounds and agents comprising the compounds as active ingredient SREBF1, GPR119, PPARG ALDH1A1 355/4885SMN1; SMN2 4577/4885HPGD 607/4885

“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.