SCHEMBL2360402

SCHEMBL2360402

O=C1CCc2c1n(C(=O)O)c1ccc(Cl)c(Cl)c21

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.35
TP53 P04637 1/20 0.35
CREBBP Q92793 1/20 0.35
MAOA P21397 2/20 0.33
ACHE P22303 2/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
PNMT P11086 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
SCHEMBL22529429 0.92 TP53 (0.39) NOTUMTP53CREBBPMAOAACHE
SCHEMBL14688848 0.92 TP53 (0.42) NOTUMTP53CREBBPMAOAACHE
SCHEMBL2360361 0.81 CCNB2 (0.36) NOTUMTP53CREBBPMAOAACHE
SCHEMBL2360526 0.79 TP53 (0.43) NOTUMTP53CREBBPKDM4EALDH1A1
SCHEMBL2360304 0.77 TP53 (0.40) TP53CREBBPMAOAACHEKDM4E
SCHEMBL2360890 0.74 TP53 (0.39) NOTUMTP53CREBBPKDM4EALDH1A1
SCHEMBL22529425 0.74 TP53 (0.37) NOTUMTP53CREBBPKDM4EALDH1A1
SCHEMBL2365506 0.69 TP53 (0.47) TP53CREBBPKDM4EALDH1A1HPGD
SCHEMBL22529386 0.69 TP53 (0.44) TP53CREBBPMAOAACHEKDM4E
SCHEMBL14688409 0.68 ALDH1A1 (0.40) TP53ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11845742-B2 Therapeutic compounds and methods to treat infection RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2023-12-19 US disclosed
US-20200325124-A1 THERAPEUTIC COMPOUNDS AND METHODS TO TREAT INFECTION RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2020-10-15 US disclosed
EP-2531029-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS Radius Health, Inc. (US) 2012-12-12 EP disclosed
WO-2011097496-A1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2011-08-11 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 (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-20200325124-A1 THERAPEUTIC COMPOUNDS AND METHODS TO TREAT INFECTION ABCB11, SLC47A1, SLC47A2 NOTUM 2194/4885TP53 4026/4885CREBBP 318/4885
US-11845742-B2 Therapeutic compounds and methods to treat infection ABCB11, SLC47A1, SLC47A2 NOTUM 2194/4885TP53 4026/4885CREBBP 318/4885

“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.