SCHEMBL5428331

SCHEMBL5428331

Cc1onc(-c2ccccc2)c1C1(O)CCN(C(=O)O)CC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
LMNA P02545 3/20 0.54
USP2 O75604 3/20 0.53
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 4/20 0.51
HTT P42858 1/20 0.51
TSHR P16473 4/20 0.50
GAA P10253 2/20 0.46
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 2/20 0.43
HIF1A Q16665 1/20 0.43
GABRA5 P31644 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL5423448 0.85 SCD5 (0.50) ALDH1A1LMNAUSP2KMT2ASMN1; SMN2
SCHEMBL3549274 0.77 ALDH1A1 (0.72) ALDH1A1LMNAUSP2KMT2ASMN1; SMN2
SCHEMBL4817503 0.72 LMNA (0.71) ALDH1A1LMNAUSP2KMT2ASMN1; SMN2
SCHEMBL4817495 0.72 LMNA (0.71) ALDH1A1LMNAUSP2KMT2ASMN1; SMN2
SCHEMBL3539489 0.69 KMT2A (1.00) ALDH1A1LMNAUSP2KMT2ASMN1; SMN2
SCHEMBL3553134 0.69 SMN1; SMN2 (0.97) ALDH1A1LMNAUSP2KMT2ASMN1; SMN2
SCHEMBL795975 0.68 ALDH1A1 (0.56) ALDH1A1LMNAKMT2AMEN1
SCHEMBL5373284 0.68 OPRM1 (0.60)
SCHEMBL2701002 0.67 ALDH1A1 (0.67) ALDH1A1LMNAUSP2KMT2ASMN1; SMN2
SCHEMBL3553965 0.67 TSHR (1.00) ALDH1A1LMNAUSP2KMT2ASMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070060629-A1 Large conductance calcium-activated k channel opener TANABE SEIYAKU CO., LTD. (JP) 2007-03-15 US disclosed
EP-1675585-A2 LARGE CONDUCTANCE CALCIUM-ACTIVATED K CHANNEL OPENER TANABE SEIYAKU CO., LTD. (JP) 2006-07-05 EP disclosed
WO-2005037271-A2 LARGE CONDUCTANCE CALCIUM-ACTIVATED K CHANNEL OPENER TANABE SEIYAKU CO., LTD. (JP) 2005-04-28 WO 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-20070060629-A1 Large conductance calcium-activated k channel opener KCNN3, KCNN1, KCNN2 ALDH1A1 3603/4885LMNA 1830/4885USP2 3734/4885

“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.