SCHEMBL4888158

SCHEMBL4888158

NCCCCC(NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(CNC2CCCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BDKRB2 P30411 1/20 0.51
▸ UTS2R Q9UKP6 1/20 0.48
▸ RUVBL1 Q9Y265 4/20 0.47
▸ LMNA P02545 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ MC4R P32245 2/20 0.46
▸ GHSR Q92847 2/20 0.46
▸ MC5R P33032 1/20 0.46
▸ MC3R P41968 1/20 0.46

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
SCHEMBL4888144 0.90 UTS2R (0.47) BDKRB2UTS2RRUVBL1GHSR
SCHEMBL4888152 0.84 MME (0.49) BDKRB2UTS2RRUVBL1GHSR
Hydrochloric Acid SCHEMBL6287792 0.83 RUVBL1 (0.54) UTS2RRUVBL1LMNAHTTKMT2A
Hydrochloric Acid SCHEMBL6290405 0.83 RUVBL1 (0.54) UTS2RRUVBL1LMNAHTTKMT2A
SCHEMBL14111057 0.82 GHSR (0.46) MC4RGHSRMC5RMC3R
SCHEMBL4885609 0.79 CPB2 (0.51) BDKRB2
SCHEMBL4886971 0.79 CHRNB2 (0.52) BDKRB2
SCHEMBL29603261 0.78 KDM4E (0.59) UTS2RLMNAKMT2AMC4RGHSR
SCHEMBL1387764 0.78 KDM4E (0.61) LMNAKMT2AMC4RGHSRMC5R
SCHEMBL14906252 0.78 KDM4E (0.61) LMNAKMT2AMC4RGHSRMC5R

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-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-17 — — US disclosed
US-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-25 — — 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 (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-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF HAVCR2, ADAR, NSUN2 BDKRB2 3972/4885UTS2R 2145/4885RUVBL1 1245/4885
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE POLQ, POLI, POLH BDKRB2 4288/4885UTS2R 4276/4885RUVBL1 3359/4885

“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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