SCHEMBL5898588

SCHEMBL5898588

CCC(O)(CC(N)=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP2C19 P33261 2/20 0.44
HIF1A Q16665 1/20 0.44
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 1/20 0.42
CHRM3 P20309 1/20 0.41
KCNN4 O15554 5/20 0.41
KIF11 P52732 1/20 0.41
HTT P42858 2/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP2D6 P10635 1/20 0.38
KDM4E B2RXH2 1/20 0.38
APOBEC3A P31941 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
RIPK1 Q13546 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
SCHEMBL687446 0.85 CYP2C19 (0.57) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL7056948 0.85 CYP2C19 (0.57) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL295742 0.85 CYP2C19 (0.57) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL6262957 0.84 KIF11 (0.47) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL19130513 0.83 CYP2C19 (0.46) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL8358159 0.82 MAPT (0.45) MAPTKMT2AHIF1ACYP1A2LMNA
SCHEMBL8363409 0.82 KCNN4 (0.52) MAPTKMT2AKCNN4HTTKDM4E
SCHEMBL5898523 0.82 SMN1; SMN2 (0.40) KMT2AKIF11SMN1; SMN2
SCHEMBL5898545 0.82 MAPT (0.43) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL28833568 0.82 SCN5A (0.50) MAPTKMT2AKIF11LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5463125-A 3-hydroxy-3-phenylpentamide SANDOVAL GUILLERMO C (MX) 1995-10-31 US claimed
CN-113930351-B Application of GGH gene in increasing yield of tocopherol, recombinant yarrowia lipolytica for high yield of tocotrienol and application of recombinant yarrowia lipolytica 陕西海斯夫生物工程有限公司 2022-11-29 CN disclosed
US-20060287397-A1 Dl-hydroxy-alkyl-phenylamides having anticonvulsive activity MEZA TOLEDO SERGIO E 2006-12-21 US disclosed
WO-1997023202-A1 SUBTYPE-SELECTIVE NMDA RECEPTOR LIGANDS AND THE USE THEREOF STATE OF OREGON, acting by and through THE OREGON STATE BOARD OF HIGHER EDUCATION, acting for and on behalf of THE OREGON HEALTH SCIENCES UNIVERSITYA ND THE UNIVERSITY OF OREGON, EUGENE OREGON (US) 1997-07-03 WO disclosed
US-5463125-A 3-hydroxy-3-phenylpentamide SANDOVAL GUILLERMO C (MX) 1995-10-31 US disclosed
US-5463125-A 3-hydroxy-3-phenylpentamide SANDOVAL GUILLERMO C (MX) 1995-10-31 US 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-20060287397-A1 Dl-hydroxy-alkyl-phenylamides having anticonvulsive activity GABRB2, HRH3, HRH4 MAPT 2331/4885KMT2A 211/4885CYP2C19 1452/4885

“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.