SCHEMBL21362075

SCHEMBL21362075

CCSNc1cc(Br)c(C(=O)c2ccc(F)cc2)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
CHRNA7 P36544 2/20 0.36
KCNH2 Q12809 3/20 0.35
KCNMA1 Q12791 1/20 0.34
KDM4E B2RXH2 1/20 0.34
RAB9A P51151 1/20 0.34
RXRA P19793 1/20 0.33

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
SCHEMBL21362215 0.90 KMT2A (0.41) TP53LMNAMAPTHTTKMT2A
SCHEMBL20158009 0.88 GAA (0.38) TP53LMNAMAPTHTTKMT2A
SCHEMBL21362156 0.79 CXCR2 (0.38) TP53LMNAMAPTHTTKMT2A
SCHEMBL20157704 0.75 NPC1 (0.44) TP53LMNAMAPTHTTKMT2A
SCHEMBL20157868 0.74 SMN1; SMN2 (0.45) TP53LMNAMAPTHTTKMT2A
SCHEMBL20157479 0.74 MAPT (0.38) TP53LMNAMAPTHTTKMT2A
SCHEMBL20157993 0.73 PTPN1 (0.40) TP53LMNAMAPTHTTKMT2A
SCHEMBL20157680 0.72 POLB (0.42) MAPTHTTALDH1A1HPGDRXRA
SCHEMBL20157994 0.72 KMT2A (0.38) TP53LMNAMAPTHTTKMT2A
SCHEMBL20157667 0.71 MAPT (0.43) TP53LMNAMAPTHTTKMT2A

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 TP53 197/4885LMNA 2333/4885MAPT 237/4885

“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.