SCHEMBL19002285

SCHEMBL19002285

CCC(=O)NCCc1ccc(OC)nc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACACB O00763 2/20 0.51
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
MTNR1A P48039 2/20 0.47
MTNR1B P49286 2/20 0.47

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
SCHEMBL18997639 0.86 KDM4E (0.47) ACACBKDM4EMEN1MAPTKMT2A
SCHEMBL5008474 0.85 NAMPT (0.52) KDM4EMEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL5012099 0.84 NAMPT (0.51) KDM4EMEN1MAPTKMT2A
SCHEMBL19051523 0.83 SMN1; SMN2 (0.49) MAPT
SCHEMBL21900625 0.83 KMT2A (0.44) ACACBKDM4EMEN1MAPTKMT2A
SCHEMBL24160954 0.82 MTNR1A (0.46) ACACBKDM4EMEN1MAPTKMT2A
SCHEMBL24943197 0.82 MTNR1A (0.46) ACACBKDM4EMEN1MAPTKMT2A
SCHEMBL18997712 0.82 MTNR1A (0.46) ACACBKDM4EMEN1MAPTKMT2A
SCHEMBL19002286 0.81 ACACB (0.51) ACACBKDM4EMEN1MAPTKMT2A
SCHEMBL19001316 0.81 ACACB (0.48) ACACBMTNR1AMTNR1B

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
WO-2017112777-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC (US) 2017-06-29 WO 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 (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 ACACB 807/4885KDM4E 3392/4885MEN1 4080/4885

“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.