SCHEMBL14270252

SCHEMBL14270252

CC(C)(C)OC(=O)N1CCN(CCN=[N+]=[N-])CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ CHRM2 P08172 1/20 0.42
▸ CHRM4 P08173 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM3 P20309 1/20 0.42
▸ ACKR3 P25106 2/20 0.40
▸ RECQL P46063 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ TLR8 Q9NR97 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL23301354 0.92 TLR8 (0.42) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL16898492 0.88 USP2 (0.39) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL16898465 0.87 USP2 (0.38) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL16898644 0.87 USP2 (0.38) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL31706305 0.87 MEN1 (0.41) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL16898385 0.87 USP2 (0.38) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL16898400 0.87 USP2 (0.38) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL28853609 0.83 HPGD (0.41) USP2SMN1; SMN2CHRM2CHRM1ACKR3
SCHEMBL8242595 0.82 USP2 (0.61) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL16906830 0.81 USP2 (0.38) USP2SMN1; SMN2CHRM2CHRM4CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242474-A1 LIPID COMPOUND AND THE COMPOSITION THEREOF GUANGZHOU RIBOBIO CO., LTD. (CN) 2023-08-03 — — US disclosed
US-20150158901-A1 MACROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME BioVersys AG (CH) 2015-06-11 — — US disclosed
US-20150158901-A1 MACROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME BioVersys AG (CH) 2015-06-11 — — US disclosed
US-8841263-B2 Macrocyclic compounds and methods of making and using the same MELINTA THERAPEUTICS, INC. (US) 2014-09-23 — — US disclosed
US-20120252747-A1 MACROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME SILICON VALLEY BANK 2012-10-04 — — US disclosed
US-8202843-B2 Macrocyclic compounds and methods of making and using the same RIB-X PHARMACEUTICALS, INC. (US) 2012-06-19 — — US disclosed
US-8202843-B2 Macrocyclic compounds and methods of making and using the same RIB-X PHARMACEUTICALS, INC. (US) 2012-06-19 — — US disclosed
US-20080045585-A1 Macrocyclic Compounds And Methods Of Making And Using The Same BioVersys AG (CH) 2008-02-21 — — US disclosed
US-20080045585-A1 Macrocyclic Compounds And Methods Of Making And Using The Same BioVersys AG (CH) 2008-02-21 — — 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 (4 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-20150158901-A1 MACROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME CCNO, PTGDR, CCNE1 USP2 4706/4885SMN1; SMN2 2993/4885CHRM2 1854/4885
US-20120252747-A1 MACROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME CCNO, PTGDR, CCNE1 USP2 4706/4885SMN1; SMN2 2993/4885CHRM2 1854/4885
US-20080045585-A1 Macrocyclic Compounds And Methods Of Making And Using The Same VIP, PROKR1, PGC USP2 4480/4885SMN1; SMN2 3139/4885CHRM2 3436/4885
US-20230242474-A1 LIPID COMPOUND AND THE COMPOSITION THEREOF NPC1L1, NPC1, SGMS1 USP2 4480/4885SMN1; SMN2 1680/4885CHRM2 2699/4885

“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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