SCHEMBL21362088

SCHEMBL21362088

CCS(=O)(=O)Cc1ccc(C(=O)c2ccc(F)cc2)c(-c2cn(C)c(=O)cc2F)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 11/20 0.42
THRB P10828 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAP2K2 P36507 1/20 0.35
MAP2K1 Q02750 1/20 0.35
MAPT P10636 2/20 0.35
ATM Q13315 1/20 0.35
EP300 Q09472 1/20 0.35
BRD2 P25440 1/20 0.34
BRD3 Q15059 1/20 0.34
BRDT Q58F21 1/20 0.34
PRNP P04156 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL20157691 0.88 MAP2K2 (0.45) BRD4THRBSMN1; SMN2MAP2K2MAP2K1
SCHEMBL21362118 0.87 BRD4 (0.42) BRD4MAP2K2MAP2K1EP300BRD2
SCHEMBL21362394 0.87 BRD4 (0.39) BRD4THRBMAP2K2MAP2K1MAPT
SCHEMBL21351829 0.86 BRD4 (0.39) BRD4THRBSMN1; SMN2MAPTATM
SCHEMBL21354516 0.86 BRD4 (0.37) BRD4THRBSMN1; SMN2MAPTATM
SCHEMBL21352089 0.82 BRD4 (0.36) BRD4THRBSMN1; SMN2MAPTATM
SCHEMBL21352183 0.82 BRD4 (0.36) BRD4THRBMAPT
SCHEMBL21352087 0.82 BRD4 (0.41) BRD4THRB
SCHEMBL21352206 0.82 BRD4 (0.36) BRD4THRBMAPT
SCHEMBL21362098 0.81 BRD4 (0.37) BRD4THRBSMN1; SMN2MAPT

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-20190284192-A1 NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF SHANDONG LUOXIN PHARMACEUTICAL GROUP STOCK CO., LTD. (CN) 2019-09-19 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-20190284192-A1 NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF MYC, BRD1, BRD3 BRD4 7/4885THRB 2103/4885SMN1; SMN2 4369/4885

“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.