SCHEMBL14372292

SCHEMBL14372292

COc1ccc2nccc(NC(=O)C3CCCC(CNCc4cc5c(cc4F)SCC(=O)N5)C3)c2c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.42
ROCK2 O75116 1/20 0.36
MAOA P21397 2/20 0.35
MAOB P27338 2/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
SLC2A1 P11166 1/20 0.34
HTR1A P08908 1/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 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
SCHEMBL14372282 0.90 MTNR1B (0.39) KCNH2MAOAMAOBMEN1KMT2A
SCHEMBL14372285 0.90 KCNH2 (0.47) KCNH2MAOAMAOBMEN1KMT2A
SCHEMBL14372279 0.87 KCNH2 (0.42) KCNH2
SCHEMBL14372295 0.80 SLC2A1 (0.37) KCNH2KDM4EMEN1CYP1A2KMT2A
SCHEMBL14372283 0.80 MTNR1B (0.40) KCNH2MAOAMAOBMEN1KMT2A
SCHEMBL14372284 0.79 KCNH2 (0.54) KCNH2KDM4ETRPV1HTR1A
SCHEMBL14372288 0.79 KCNH2 (0.52) KCNH2KDM4EMEN1CYP1A2RECQL
SCHEMBL14372267 0.77 KCNH2 (0.43) KCNH2
SCHEMBL14341455 0.76 KCNH2 (0.65) KCNH2
SCHEMBL14372286 0.76 KCNH2 (0.65) KCNH2KDM4EMEN1CYP1A2RECQL

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-20070244103-A1 Novel Compounds Having an Anti-Bacterial Activity MORPHOCHEM AKTIENGESELLSCHAFT FUR KOMBINATORISCHE CHEMIE (DE) 2007-10-18 US disclosed
US-20070244103-A1 Novel Compounds Having an Anti-Bacterial Activity MORPHOCHEM AKTIENGESELLSCHAFT FUR KOMBINATORISCHE CHEMIE (DE) 2007-10-18 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-20070244103-A1 Novel Compounds Having an Anti-Bacterial Activity TOP1, TOP2A, TOP2B KCNH2 3363/4885ROCK2 2265/4885MAOA 1509/4885

“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.