SCHEMBL4398015

SCHEMBL4398015

O=C1CCCN1CCCCNCCCCN1CCCC1=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
POLB P06746 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MALT1 Q9UDY8 1/20 0.47
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
MEN1 O00255 2/20 0.46
ADRA1B P35368 2/20 0.44
ADRA1A P35348 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
DRD4 P21917 1/20 0.44
TSHR P16473 1/20 0.44
PIK3CD O00329 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
SCHEMBL4394146 0.94 KMT2A (0.52) KMT2APOLBTDP1MALT1RAB9A
Hydrochloric Acid SCHEMBL10380721 0.87 KMT2A (0.53) KMT2APOLBTDP1MALT1RAB9A
SCHEMBL24999556 0.87 RAB9A (0.48) KMT2APOLBTDP1MALT1RAB9A
SCHEMBL9685143 0.87 RAB9A (0.48) KMT2APOLBTDP1MALT1RAB9A
SCHEMBL12847181 0.86 RAB9A (0.50) KMT2APOLBTDP1MALT1RAB9A
SCHEMBL4396522 0.86 KMT2A (0.59) KMT2APOLBTDP1MALT1MEN1
SCHEMBL31632694 0.86 PIK3CD (0.52) KMT2APOLBTDP1MALT1MEN1
SCHEMBL989008 0.86 PIK3CD (0.52) KMT2APOLBTDP1MALT1MEN1
SCHEMBL19514132 0.86 PIK3CD (0.52) KMT2APOLBTDP1MALT1MEN1
SCHEMBL5697292 0.86 PIK3CD (0.52) KMT2APOLBTDP1MALT1MEN1

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-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME MITSUI CHEMICALS, INC. (JP) 2009-12-10 US disclosed
US-20070054084-A1 Optical recording medium and compound used for the same MITSUI CHEMICALS, INC. (JP) 2007-03-08 US disclosed
EP-1672626-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED IN THE OPTICAL RECORDING MEDIUM Mitsui Chemicals, Inc. (JP) 2006-06-21 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-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME CACNA1B, KCNN4, KCNN2 KMT2A 3032/4885POLB 3906/4885TDP1 4127/4885

“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.