SCHEMBL14975398

SCHEMBL14975398

CC(COc1ccccc1)(NC(=O)c1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.46
RAB9A P51151 3/20 0.46
CASP3 P42574 2/20 0.46
SENP7 Q9BQF6 2/20 0.46
POLB P06746 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
PPARA Q07869 4/20 0.45
PPARG P37231 3/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
BCL2L1 Q07817 1/20 0.44
MCL1 Q07820 1/20 0.44
ALDH1A1 P00352 2/20 0.44
FABP2 P12104 2/20 0.44
PPARD Q03181 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
SLC22A12 Q96S37 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL5309684 0.77 ALPL (0.44) NPC1RAB9ACASP3SENP7POLB
SCHEMBL11363896 0.77 PPARA (0.48) NPC1RAB9ACASP3SENP7POLB
SCHEMBL14975402 0.73 PPARA (0.60) NPC1RAB9ACASP3SENP7POLB
SCHEMBL28451349 0.72 POLB (0.56) NPC1RAB9APOLBSMN1; SMN2KMT2A
SCHEMBL10940237 0.72 ALDH1A1 (0.43) NPC1RAB9APOLBSMN1; SMN2PPARA
SCHEMBL10940243 0.72 ALDH1A1 (0.43) NPC1RAB9APOLBSMN1; SMN2PPARA
SCHEMBL3755534 0.72 POLB (0.56) NPC1RAB9APOLBSMN1; SMN2PPARA
SCHEMBL3465226 0.72 PPARA (0.47) NPC1RAB9ACASP3SENP7POLB
SCHEMBL787527 0.72 CXCR2 (0.46)
SCHEMBL28908852 0.72 POLB (0.53) NPC1RAB9APOLBSMN1; SMN2PPARA

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-20140371316-A1 DERIVATIVES OF PHENOXYISOBUTYRIC ACID FABRICANT JILL S (US) 2014-12-18 US disclosed
EP-2782902-A2 DERIVATIVES OF PHENOXYISOBUTYRIC ACID Fabricant, Jill, S. (US) 2014-10-01 EP disclosed
WO-2013078446-A2 DERIVATIVES OF PHENOXYISOBUTYRIC ACID FABRICANT JILL S (US) 2013-05-30 WO 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-20140371316-A1 DERIVATIVES OF PHENOXYISOBUTYRIC ACID AGER, BPGM, FOSB NPC1 4757/4885RAB9A 1613/4885CASP3 460/4885

“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.