SCHEMBL13668151

SCHEMBL13668151

OB(O)CCCCCn1cnc2cccc(Cl)c21

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRPS1 P60891 5/20 0.50
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
LMNA P02545 2/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 2/20 0.35
HTR1A P08908 4/20 0.35
HTR7 P34969 4/20 0.35
TDP1 Q9NUW8 1/20 0.34
PSMB8 P28062 1/20 0.34
NR1I2 O75469 1/20 0.34
PRMT5 O14744 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
SCHEMBL13668150 0.84 PRPS1 (0.37) PRPS1DPP4DPP8LMNARAB9A
SCHEMBL8268099 0.83 FGFR1 (0.43) PRPS1DPP4LMNAALOX15TSHR
SCHEMBL308832 0.78 DPP4 (0.58) PRPS1DPP4DPP8LMNAGAA
SCHEMBL13668116 0.77 TDP1 (0.62) LMNARAB9AALOX15TSHRSMN1; SMN2
SCHEMBL13668131 0.77 TDP1 (0.62) LMNARAB9AALOX15TSHRSMN1; SMN2
SCHEMBL13668154 0.77 LMNA (0.39) LMNAGAATSHRSMN1; SMN2POLB
SCHEMBL8268097 0.76 TDP1 (0.64) LMNARAB9AALOX15TSHRSMN1; SMN2
SCHEMBL8267129 0.74 PRPS1 (0.51) PRPS1DPP4DPP8LMNAALOX15
SCHEMBL13668156 0.73 PRPS1 (0.50) PRPS1LMNAGAARAB9AALOX15
SCHEMBL13668153 0.73 PRPS1 (0.50) PRPS1LMNARAB9AALOX15TSHR

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-20090264384-A1 INDOLE, BENZIMIDAZOLE, AND BENZOLACTAM BORONIC ACID COMPOUNDS, ANALOGS THEREOF AND METHODS OF USE THEREOF NUADA, INC. (US) 2009-10-22 US disclosed
US-20090005344-A1 Compounds and Methods of Use Thereof NKUADA, LLC (US) 2009-01-01 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 (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-20090005344-A1 Compounds and Methods of Use Thereof TNF, IL1B, TNFRSF1A PRPS1 1826/4885DPP4 1467/4885DPP8 1120/4885
US-20090264384-A1 INDOLE, BENZIMIDAZOLE, AND BENZOLACTAM BORONIC ACID COMPOUNDS, ANALOGS THEREOF AND METHODS OF USE THEREOF TNF, NFKBIA, IL6 PRPS1 2641/4885DPP4 2431/4885DPP8 3057/4885

“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.