SCHEMBL13721779

SCHEMBL13721779

CC(C)(C)N(Cc1n[nH]c(=O)c2ccccc12)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.61
▸ LMNA P02545 1/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ AR P10275 8/20 0.51
▸ PARP1 P09874 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ PRMT5 O14744 1/20 0.50
▸ KDM4E B2RXH2 2/20 0.49
▸ KMT2A Q03164 2/20 0.46
▸ ROCK2 O75116 1/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ BLM P54132 1/20 0.44

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
SCHEMBL23087947 0.84 PRMT5 (0.42) POLBLMNASMN1; SMN2ARPARP1
SCHEMBL23087487 0.77 PRMT5 (0.62) POLBLMNASMN1; SMN2ARPARP1
SCHEMBL11412658 0.76 POLB (1.00) POLBLMNASMN1; SMN2ARPARP1
SCHEMBL5163309 0.74 POLB (0.72) POLBLMNASMN1; SMN2ARPARP1
SCHEMBL13721614 0.74 ALOX15 (0.42) POLBLMNASMN1; SMN2ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL6279576 0.73 POLB (0.70) POLBLMNASMN1; SMN2ARPARP1
SCHEMBL5717747 0.73 LMNA (1.00) POLBLMNASMN1; SMN2ARPARP1
SCHEMBL30151141 0.73 LMNA (1.00) POLBLMNASMN1; SMN2ARPARP1
SCHEMBL10177081 0.71 SMN1; SMN2 (0.64) POLBLMNASMN1; SMN2ARPARP1
SCHEMBL30231202 0.71 PRMT5 (0.68) POLBLMNASMN1; SMN2ARPARP1

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-8859549-B2 Potassium channel modulators ABBVIE, INC. (US) 2014-10-14 — — US disclosed
US-20120289500-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2012-11-15 — — 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-20120289500-A1 POTASSIUM CHANNEL MODULATORS KCNQ1, KCNQ2, KCNJ2 POLB 4320/4885LMNA 1022/4885SMN1; SMN2 1602/4885

“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.

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