SCHEMBL963949

SCHEMBL963949

CC(C)COC(=O)Nc1cccnc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
LMNA P02545 3/20 0.53
HTT P42858 3/20 0.52
RAB9A P51151 7/20 0.52
NPC1 O15118 5/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
PKM P14618 3/20 0.50
CHRNA7 P36544 1/20 0.50
TSHR P16473 2/20 0.49
MAPK1 P28482 1/20 0.49
ALOX15 P16050 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NOTUM Q6P988 1/20 0.49
NAMPT P43490 1/20 0.49
MAPT P10636 1/20 0.49
TP53 P04637 1/20 0.49

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
SCHEMBL30352411 1.00 ALDH1A1 (0.53) ALDH1A1LMNAHTTRAB9ANPC1
SCHEMBL22550640 0.89 RAB9A (0.52) ALDH1A1LMNAHTTRAB9ANPC1
SCHEMBL20717842 0.89 RAB9A (0.52) ALDH1A1LMNAHTTRAB9ANPC1
SCHEMBL22550368 0.89 RAB9A (0.52) ALDH1A1LMNAHTTRAB9ANPC1
SCHEMBL22550658 0.87 RAB9A (0.54) LMNAHTTRAB9ANPC1SMN1; SMN2
SCHEMBL22550491 0.87 RAB9A (0.54) LMNAHTTRAB9ANPC1SMN1; SMN2
SCHEMBL964915 0.86 CHRNA7 (0.54) ALDH1A1HTTRAB9ANPC1SMN1; SMN2
SCHEMBL22793243 0.85 CTSK (0.49) LMNAHTTRAB9ANPC1MEN1
SCHEMBL964959 0.83 CHRNA7 (0.58) ALDH1A1LMNAHTTRAB9ANPC1
SCHEMBL966665 0.83 NPC1 (0.59) ALDH1A1LMNAHTTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200325177-A1 METHODS OF MAKING STREPTOGRAMIN COMPOSITIONS AND THE USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-10-15 US disclosed
EP-2471775-B1 Manufacturing method for a piperidine-3-ylcarbamate compound and optical resolution method therefor SUMITOMO CHEMICAL CO (JP) 2013-01-23 EP disclosed
EP-2471775-A1 Manufacturing method for a piperidine-3-ylcarbamate compound and optical resolution method therefor SUMITOMO CHEMICAL CO., LTD. (JP) 2012-07-04 EP disclosed
CN-101977899-A Manufacturing method for a piperidine-3-ylcarbamate compound and optical resolution method therefor SUMITOMO CHEMICAL CO 2011-02-16 CN disclosed
US-20110021780-A1 MANUFACTURING METHOD FOR A PIPERIDINE-3-YLCARBAMATE COMPOUND AND OPTICAL RESOLUTION METHOD THEREFOR SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-27 US disclosed
CN-101952252-A Process for optical resolution of alkyl piperidin-3-ylcarbamates and intermediates therefor SUMITOMO CHEMICAL CO 2011-01-19 CN disclosed
EP-2269986-A1 MANUFACTURING METHOD FOR A PIPERIDINE-3-YLCARBAMATE COMPOUND AND OPTICAL RESOLUTION METHOD THEREFOR Sumitomo Chemical Company, Limited (JP) 2011-01-05 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 (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-20200325177-A1 METHODS OF MAKING STREPTOGRAMIN COMPOSITIONS AND THE USE THEREOF PLG, LIPA, MB ALDH1A1 4479/4885LMNA 360/4885HTT 3456/4885
US-20110021780-A1 MANUFACTURING METHOD FOR A PIPERIDINE-3-YLCARBAMATE COMPOUND AND OPTICAL RESOLUTION METHOD THEREFOR PDCD2L, NOTUM, OXA1L ALDH1A1 516/4885LMNA 4281/4885HTT 1801/4885

“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.