SCHEMBL3886255

SCHEMBL3886255

CCOC(=O)C(/C=C/C(C)C)C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 2/20 0.37
ALOX15 P16050 1/20 0.37
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
HCAR2 Q8TDS4 1/20 0.35
TRPA1 O75762 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GLO1 Q04760 1/20 0.34
FHIT P49789 1/20 0.33
METAP2 P50579 1/20 0.33
METAP1 P53582 1/20 0.33
HPGD P15428 2/20 0.33

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
SCHEMBL3886257 1.00 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10GAAALOX15
SCHEMBL5088265 0.90 HCAR2 (0.36) ALDH1A1LMNAHSD17B10GAAALOX15
SCHEMBL5088264 0.90 HCAR2 (0.36) ALDH1A1LMNAHSD17B10GAAALOX15
SCHEMBL10897356 0.86 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10GAAALOX15
SCHEMBL10897365 0.86 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10GAAALOX15
SCHEMBL30831370 0.86 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10GAAALOX15
SCHEMBL10062279 0.82 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10GAAALOX15
SCHEMBL2915798 0.79 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10GAAALOX15
SCHEMBL16193061 0.78 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10GAAALOX15
SCHEMBL28386714 0.77 ALOX15 (0.42) ALDH1A1LMNAHSD17B10GAAALOX15

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
WO-2023122778-A1 PYRIDAZINONE DERIVATIVES USEFUL AS T CELL ACTIVATORS GOSSAMER BIO SERVICES, INC. (US) 2023-06-29 WO disclosed
US-20120142949-A1 PROCESS FOR PREPARING PREGABALIN HELVETICA INDUSTRIES (P) LIMITED (IN) 2012-06-07 US disclosed
US-20120142949-A1 PROCESS FOR PREPARING PREGABALIN HELVETICA INDUSTRIES (P) LIMITED (IN) 2012-06-07 US disclosed
WO-2008062460-A3 CRYSTALLINE FORMS OF PREGABALIN CADILA HEALTHCARE LTD (IN) 2009-01-15 WO disclosed
WO-2008062460-A2 CRYSTALLINE FORMS OF PREGABALIN CADILA HEALTHCARE LIMITED (IN) 2008-05-29 WO disclosed
WO-2008062460-A2 CRYSTALLINE FORMS OF PREGABALIN CADILA HEALTHCARE LIMITED (IN) 2008-05-29 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-20120142949-A1 PROCESS FOR PREPARING PREGABALIN GRHPR, GABRG2, GABRG1 ALDH1A1 214/4885LMNA 1662/4885HSD17B10 55/4885

“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.