SCHEMBL21351900

SCHEMBL21351900

CC(c1ccc(C(=O)c2ccc(F)cc2)c(Br)c1)S(=O)(=O)OC(=O)N(C)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.35
KMT2A Q03164 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
ALDH1A1 P00352 2/20 0.30
LMNA P02545 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
ALPG P10696 1/20 0.30
LTC4S Q16873 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL21354519 0.81 KMT2A (0.35) KMT2ACA12CA1CA2CA9
SCHEMBL21362658 0.78 AAK1 (0.35) CNR2KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL21352249 0.78 BACE1 (0.34) CNR2KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL21354512 0.77 MAPK14 (0.35) CNR2KMT2ARXFP1
SCHEMBL20157564 0.73 LMNA (0.42) KMT2ACA1CA2ALDH1A1LMNA
SCHEMBL20158053 0.73 C5AR1 (0.36) CNR2CA2ALDH1A1LMNAGAA
SCHEMBL21352247 0.73 LMNA (0.36) CNR2KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL21351899 0.73 CNR2 (0.35) CNR2KMT2AALDH1A1LMNA
SCHEMBL20157556 0.72 LMNA (0.44) KMT2ACA1CA2ALDH1A1LMNA
SCHEMBL20158052 0.70 LMNA (0.39) KMT2AALDH1A1LMNASMN1; SMN2ALPG

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 2 patents. 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
EP-3539960-A1 NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF Luoxin Pharmaceutical (Shanghai) Co., Ltd. (CN) 2019-09-18 EP 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 CNR2 503/4885KMT2A 1082/4885CA12 4568/4885

“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.