SCHEMBL13246726

SCHEMBL13246726

CC(C)(C)C(=O)Cc1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
PPARA Q07869 1/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.45
ALDH1A1 P00352 2/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
SHMT1 P34896 1/20 0.43
SHMT2 P34897 1/20 0.43
CTBP2 P56545 1/20 0.43
POLB P06746 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ABCC4 O15439 1/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
PTGS1 P23219 1/20 0.41

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
SCHEMBL1477511 0.94 L3MBTL1 (0.54) L3MBTL1NPC1RAB9ALMNAMAPT
SCHEMBL18751674 0.84 CES1 (0.46) L3MBTL1LMNAALDH1A1RXRARXRB
SCHEMBL12895712 0.83 LMNA (0.62) LMNAMAPTALDH1A1RXRARXRB
SCHEMBL7151264 0.79 NPC1 (0.50) L3MBTL1PPARANPC1RAB9ALMNA
SCHEMBL16722805 0.78 ELANE (0.52) L3MBTL1LMNAALDH1A1RXRARXRB
SCHEMBL8233804 0.77 L3MBTL1 (0.67) L3MBTL1PPARANPC1RAB9ALMNA
SCHEMBL8980228 0.76 CA2 (0.56) NPC1RAB9ALMNACTBP2MAPK1
SCHEMBL4211639 0.76 ABCC4 (0.69) L3MBTL1NPC1RAB9ALMNAMAPT
SCHEMBL18116111 0.76 CA2 (0.56) LMNAMAPTALDH1A1RXRARXRB
SCHEMBL11389533 0.76 HPGD (0.55) L3MBTL1NPC1RAB9ALMNAALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150337013-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS MERCK SHARP & DOHME CORP. (US) 2015-11-26 US disclosed
US-20140073558-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CUBIST PHARMACEUTICALS, INC. (US) 2014-03-13 US disclosed
US-8507647-B2 Antibacterial agents for the treatment of gram positive infections CUBIST PHARMACEUTICALS, INC. (US) 2013-08-13 US disclosed
US-20100184649-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CUBIST PHARMACEUTICALS, INC. 2010-07-22 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 (3 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-20150337013-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CLPP, CLPTM1, RPN1 L3MBTL1 1585/4885PPARA 2275/4885NPC1 2676/4885
US-20100184649-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CLPP, CLPTM1, RPN1 L3MBTL1 1585/4885PPARA 2275/4885NPC1 2676/4885
US-20140073558-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CLPP, CLPTM1, RPN1 L3MBTL1 1585/4885PPARA 2275/4885NPC1 2676/4885

“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.