SCHEMBL19002363

SCHEMBL19002363

CCN(CC(=O)Nc1ccccc1OC)CC(C)C

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.67
MAPT P10636 3/20 0.67
GAA P10253 2/20 0.67
MAPK1 P28482 1/20 0.67
HTT P42858 1/20 0.67
LMNA P02545 3/20 0.65
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
POLB P06746 1/20 0.51
HSD17B10 Q99714 1/20 0.49
USP2 O75604 1/20 0.49
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL19002367 0.89 ALDH1A1 (0.76) ALDH1A1MAPTGAAMAPK1HTT
SCHEMBL23222281 0.84 ALDH1A1 (0.70) ALDH1A1MAPTGAAMAPK1HTT
SCHEMBL18997331 0.82 LMNA (0.69) ALDH1A1MAPTGAAMAPK1HTT
SCHEMBL1644874 0.78 ALDH1A1 (0.61) ALDH1A1MAPTGAAMAPK1HTT
SCHEMBL11003870 0.77 HTT (0.64) ALDH1A1MAPTGAAMAPK1HTT
SCHEMBL2098520 0.77 ALDH1A1 (0.61) ALDH1A1MAPTGAAMAPK1HTT
SCHEMBL4780753 0.76 SMN1; SMN2 (0.72) ALDH1A1MAPTGAAMAPK1HTT
SCHEMBL2007035 0.75 MEN1 (0.76) ALDH1A1MAPTHTTLMNAKMT2A
SCHEMBL9191016 0.74 ALDH1A1 (0.65) ALDH1A1MAPTHTTLMNAKMT2A
SCHEMBL31146391 0.74 ALDH1A1 (0.65) ALDH1A1MAPTHTTLMNAKMT2A

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
EP-3394056-B1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC (US) 2021-04-14 EP disclosed
US-10221191-B2 Compounds for the treatment of cancer and inflammatory disease SHY Therapeutics LLC 2019-03-05 US disclosed
US-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC 2017-06-22 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 (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-10221191-B2 Compounds for the treatment of cancer and inflammatory disease MAPK6, MAP3K6, MAPK4 ALDH1A1 2765/4885MAPT 2731/4885GAA 2713/4885
US-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE MAPK6, MAP3K6, MAPK4 ALDH1A1 2765/4885MAPT 2731/4885GAA 2713/4885

“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.