SCHEMBL19002824

SCHEMBL19002824

CCC(O)COCC1CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.41
WDR77 Q9BQA1 2/20 0.41
LMNA P02545 3/20 0.35
ADRB1 P08588 2/20 0.35
CYP2D6 P10635 1/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 2/20 0.34
USP2 O75604 1/20 0.34
ADRB2 P07550 1/20 0.34
GAA P10253 1/20 0.34
BLM P54132 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
HTT P42858 2/20 0.33
CNR2 P34972 1/20 0.33
HSD17B10 Q99714 1/20 0.32
APOBEC3A P31941 2/20 0.31

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
SCHEMBL12359766 0.92 PRMT5 (0.38) PRMT5WDR77LMNAADRB1CYP2D6
SCHEMBL19840426 0.92 PRMT5 (0.38) PRMT5WDR77LMNAADRB1CYP2D6
SCHEMBL19841953 0.88 PRMT5 (0.35) PRMT5WDR77LMNAADRB1CYP2D6
SCHEMBL12359778 0.86 ALDH1A1 (0.46) PRMT5WDR77CYP2D6MEN1KMT2A
SCHEMBL21810996 0.80 USP2 (0.44) PRMT5WDR77LMNAADRB1CYP2D6
SCHEMBL18997746 0.78 PRMT5 (0.38) PRMT5WDR77LMNAADRB1CYP2D6
SCHEMBL17136129 0.77 FYN (0.46) PRMT5WDR77LMNAADRB1CYP2D6
SCHEMBL21402614 0.76 USP2 (0.42) PRMT5WDR77LMNAADRB1CYP2D6
SCHEMBL12289317 0.76 ALDH1A1 (0.31) LMNAADRB1CYP2D6MEN1CYP1A2
SCHEMBL325805 0.75 KDM4E (0.52) KDM4EUSP2HTTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE MAPK6, MAP3K6, MAPK4 PRMT5 1655/4885WDR77 1977/4885LMNA 3509/4885

“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.