SCHEMBL12548985

SCHEMBL12548985

Cc1ccc(O)c(NC(=O)c2cc(Cc3cc(C(=O)Nc4cc(C)ccc4O)cc(C(=O)Nc4cc(C)ccc4O)c3)cc(C(=O)Nc3cc(C)ccc3O)c2)c1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 5/20 0.66
▸ GAA P10253 7/20 0.56
▸ NPC1 O15118 4/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ TP53 P04637 2/20 0.56
▸ HDAC1 Q13547 1/20 0.55
▸ RAB9A P51151 3/20 0.51
▸ MAPT P10636 2/20 0.51
▸ ADRB2 P07550 1/20 0.51
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ HTT P42858 1/20 0.47

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
SCHEMBL12488034 0.88 KCNMA1 (0.71) KCNMA1GAANPC1SMN1; SMN2TP53
SCHEMBL12548976 0.86 KCNMA1 (0.71) KCNMA1GAANPC1SMN1; SMN2TP53
SCHEMBL6029542 0.84 KCNMA1 (0.84) KCNMA1GAANPC1SMN1; SMN2TP53
SCHEMBL2605540 0.83 KCNMA1 (0.82) KCNMA1GAANPC1SMN1; SMN2TP53
SCHEMBL18027729 0.83 KCNMA1 (0.71) KCNMA1GAANPC1SMN1; SMN2TP53
SCHEMBL2605548 0.82 KCNMA1 (0.82) KCNMA1GAANPC1SMN1; SMN2TP53
SCHEMBL14363236 0.80 KCNMA1 (0.77) KCNMA1GAANPC1SMN1; SMN2TP53
SCHEMBL14363234 0.80 KCNMA1 (0.72) KCNMA1GAANPC1SMN1; SMN2TP53
SCHEMBL10873010 0.80 KCNMA1 (1.00) KCNMA1GAANPC1SMN1; SMN2TP53
SCHEMBL15437080 0.79 KCNMA1 (0.68) KCNMA1GAANPC1SMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8450318-B2 Method to treat infections using anti-infective agents K.U. LEUVEN RESEARCH AND DEVELOPMENT (BE) 2013-05-28 — — US disclosed
US-8450318-B2 Method to treat infections using anti-infective agents K.U. LEUVEN RESEARCH AND DEVELOPMENT (BE) 2013-05-28 — — US disclosed
US-20110136840-A1 ANTI-INFECTIVE AGENTS MAZIK, MONIKA (DE) 2011-06-09 — — US disclosed
US-20110136840-A1 ANTI-INFECTIVE AGENTS MAZIK, MONIKA (DE) 2011-06-09 — — 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-20110136840-A1 ANTI-INFECTIVE AGENTS ICAM1, MANBA, ALG1 KCNMA1 4600/4885GAA 155/4885NPC1 1619/4885

“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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