SCHEMBL4440119

SCHEMBL4440119

COCCCCCC(=O)N1CCCCC1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.62
MEN1 O00255 4/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
TDP1 Q9NUW8 1/20 0.62
ATM Q13315 1/20 0.59
HPGD P15428 6/20 0.50
ALDH1A1 P00352 3/20 0.50
RAB9A P51151 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 2/20 0.50
MAPT P10636 1/20 0.48
TSHR P16473 1/20 0.48
NPSR1 Q6W5P4 2/20 0.48
HTT P42858 1/20 0.48

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
SCHEMBL18526705 0.91 ATM (0.65) KMT2AMEN1L3MBTL1TDP1ATM
SCHEMBL12518836 0.85 HPGD (0.58) KMT2AMEN1L3MBTL1TDP1ATM
SCHEMBL10722543 0.84 ATM (0.81) KMT2AMEN1L3MBTL1TDP1ATM
SCHEMBL2866081 0.83 GLA (0.64) L3MBTL1HPGDALDH1A1RAB9ASMN1; SMN2
SCHEMBL10404896 0.83 ATM (0.58) KMT2AMEN1L3MBTL1TDP1ATM
SCHEMBL10722542 0.82 ATM (0.85) KMT2AMEN1L3MBTL1TDP1ATM
SCHEMBL28366947 0.82 ATM (0.85) KMT2AMEN1L3MBTL1TDP1ATM
SCHEMBL27487132 0.82 ATM (0.85) KMT2AMEN1L3MBTL1TDP1ATM
SCHEMBL12282009 0.82 KDM4E (0.49) KMT2AMEN1L3MBTL1TDP1ATM
SCHEMBL2701784 0.81 GNAI3 (0.47) KMT2AMEN1L3MBTL1TDP1ATM

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-20090275581-A1 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20090264428-A1 Renin Inhibitors VITAE PHARMACEUTICALS, INC. 2009-10-22 US disclosed
WO-2008124582-A1 RENIN INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 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 (2 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-20090275581-A1 RENIN INHIBITORS REN, ACE, SERPINB1 KMT2A 4668/4885MEN1 2976/4885L3MBTL1 4439/4885
US-20090264428-A1 Renin Inhibitors REN, ACE, SERPINB1 KMT2A 4507/4885MEN1 2421/4885L3MBTL1 3320/4885

“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.