SCHEMBL19834490

SCHEMBL19834490

CC(CCc1cc(-c2ccc(Oc3cccc(OCC4CC4)c3)cc2)no1)OS(C)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 16/20 0.50
ACACB O00763 8/20 0.50
CXCR1 P25024 1/20 0.39
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
GPR183 P32249 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL19834439 0.84 ACACA (0.70) ACACAACACB
SCHEMBL19834502 0.82 ACACA (0.73) ACACAACACB
SCHEMBL19834350 0.81 ACACA (0.50) ACACAACACB
SCHEMBL19834456 0.79 ACACA (0.49) ACACAACACBCXCR1NPC1MAPT
SCHEMBL19834555 0.77 ACACA (0.47) ACACAACACBCXCR1MAPT
SCHEMBL19834568 0.77 ACACA (0.44) ACACAACACB
SCHEMBL19834606 0.74 ACACA (0.50) ACACAACACBCXCR1
SCHEMBL19834447 0.71 ACACA (0.73) ACACAACACB
SCHEMBL19834392 0.71 ACACA (0.63) ACACAACACB
SCHEMBL19834391 0.71 ACACA (0.63) ACACAACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10252997-B2 Monocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-04-09 US disclosed
US-20180079723-A1 MONOCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-03-22 US disclosed
EP-3279183-A1 MONOCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2018-02-07 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-10252997-B2 Monocyclic compound FABP1, CPT1A, GOT2 ACACA 58/4885ACACB 28/4885CXCR1 2035/4885
US-20180079723-A1 MONOCYCLIC COMPOUND FABP1, CPT1A, GOT2 ACACA 58/4885ACACB 28/4885CXCR1 2035/4885

“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.