SCHEMBL1786727

SCHEMBL1786727

COCCOCCOCCOCCCCCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MAPT P10636 1/20 0.54
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CHRM2 P08172 2/20 0.53
MEN1 O00255 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
KMT2A Q03164 1/20 0.53

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
SCHEMBL12608325 1.00 TDP1 (0.54) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL23100892 0.98 RAB9A (0.55) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL13909710 0.98 RAB9A (0.55) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL15923240 0.92 TDP1 (0.58) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL29384887 0.92 TDP1 (0.58) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL29263682 0.92 TDP1 (0.58) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL12661123 0.92 TDP1 (0.58) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL13256453 0.92 TDP1 (0.58) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL13256445 0.92 TDP1 (0.58) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL19344706 0.92 MAOB (0.50) TDP1L3MBTL1MAPTRAB9ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8772540-B2 Thermal responsive molecule KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2014-07-08 US disclosed
US-20110124916-A1 THERMAL RESPONSIVE MOLECULE KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2011-05-26 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-20110124916-A1 THERMAL RESPONSIVE MOLECULE HEATR1, HEATR6, HSPH1 TDP1 1136/4885L3MBTL1 92/4885MAPT 1552/4885

“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.