SCHEMBL5466979

SCHEMBL5466979

COC(=O)c1ccc(NC(=O)c2c[c]ccc2O)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.47
▸ NPC1 O15118 8/20 0.47
▸ MEN1 O00255 7/20 0.47
▸ RAB9A P51151 7/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ TDP1 Q9NUW8 1/20 0.44
▸ POLB P06746 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ TUBB4A P04350 1/20 0.43
▸ TUBB P07437 1/20 0.43
▸ TUBA3C P0DPH7 1/20 0.43
▸ TUBA1B P68363 1/20 0.43
▸ TUBA4A P68366 1/20 0.43
▸ TUBB4B P68371 1/20 0.43
▸ TUBB3 Q13509 1/20 0.43
▸ TUBB2A Q13885 1/20 0.43
▸ TUBB8 Q3ZCM7 1/20 0.43
▸ TUBA3E Q6PEY2 1/20 0.43
▸ TUBA1A Q71U36 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
SCHEMBL5468424 0.89 NPC1 (0.56) KMT2ANPC1MEN1RAB9ASMN1; SMN2
SCHEMBL5462595 0.89 SMN1; SMN2 (0.59) KMT2ANPC1MEN1RAB9ASMN1; SMN2
SCHEMBL5461688 0.84 HTT (0.53) KMT2ANPC1MEN1RAB9ASMN1; SMN2
SCHEMBL5463771 0.81 RAB9A (0.51) KMT2ANPC1MEN1RAB9ASMN1; SMN2
SCHEMBL5462330 0.80 PNLIP (0.62) KMT2ANPC1MEN1RAB9ASMN1; SMN2
SCHEMBL14363263 0.80 PLAU (0.53) KMT2ANPC1MEN1RAB9ASMN1; SMN2
SCHEMBL5462863 0.79 RAB9A (0.59) KMT2ANPC1MEN1RAB9ASMN1; SMN2
SCHEMBL5455080 0.79 RAB9A (0.59) KMT2ANPC1RAB9ASMN1; SMN2POLB
SCHEMBL5468300 0.77 SNCA (0.56) KMT2ANPC1MEN1RAB9A
SCHEMBL1978589 0.77 LMNA (0.55) SMN1; SMN2TDP1POLBALDH1A1NFKB1

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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 — — US disclosed
EP-1666469-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Institute of Medicinal Molecular Design, Inc. (JP) 2006-06-07 — — EP 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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 KMT2A 2948/4885NPC1 3368/4885MEN1 2892/4885

“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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