SCHEMBL12259016

SCHEMBL12259016

CNC(=O)CCC(=O)CC1C[C@H](n2cc(/C=C/C(=O)NCCNC(=O)O[C@H]3CC[C@@]4(C)C(=CCC5C4CC[C@@]4(C)C5CC[C@@H]4[C@H](C)CCCC(C)C)C3)c(=O)[nH]c2=O)O[C@@H]1COC(c1ccccc1)(c1ccc(OC)cc1)c1ccc(OC)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 1/20 0.39
APP P05067 1/20 0.38
CYP46A1 Q9Y6A2 2/20 0.37
NR1H3 Q13133 2/20 0.37
PLA2G2A P14555 1/20 0.36
EPHA2 P29317 5/20 0.36
USP2 O75604 2/20 0.35
LMNA P02545 1/20 0.35
ABCB1 P08183 1/20 0.35
OSBP P22059 1/20 0.35
RORC P51449 1/20 0.35
OSBP2 Q969R2 1/20 0.35
NPC1 O15118 1/20 0.34
NPC1L1 Q9UHC9 1/20 0.34
GBA1 P04062 2/20 0.33
UGCG Q16739 2/20 0.33
GBA2 Q9HCG7 2/20 0.33
EPHB6 O15197 1/20 0.33
EPHA1 P21709 1/20 0.33
EPHA3 P29320 1/20 0.33

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
SCHEMBL13610651 0.93 POLA1 (0.39) POLA1APPCYP46A1NR1H3PLA2G2A
SCHEMBL13032470 0.93 POLA1 (0.39) POLA1APPCYP46A1NR1H3PLA2G2A
SCHEMBL13610648 0.84 POLA1 (0.36) POLA1APPCYP46A1NR1H3PLA2G2A
SCHEMBL12259014 0.84 POLA1 (0.36) POLA1APPCYP46A1NR1H3PLA2G2A
SCHEMBL11992553 0.77 PLA2G2A (0.47) POLA1APPCYP46A1NR1H3PLA2G2A
SCHEMBL13610652 0.77 EPHA2 (0.40) EPHA2LMNA
SCHEMBL12258949 0.76 POLA1 (0.49) POLA1CYP46A1NR1H3PLA2G2AEPHA2
SCHEMBL11992542 0.76 PLA2G2A (0.46) POLA1APPCYP46A1NR1H3PLA2G2A
SCHEMBL24141990 0.76 POLA1 (0.45) POLA1APPCYP46A1NR1H3PLA2G2A
SCHEMBL4546174 0.76 POLA1 (0.45) POLA1APPCYP46A1NR1H3PLA2G2A

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-8017763-B2 Chemically modified oligonucleotides ALNYLAM PHARMACEUTICALS, INC. (US) 2011-09-13 US disclosed
US-20100069471-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES ALNYLAM PHARMACEUTICALS, INC. (US) 2010-03-18 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 (1 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-20100069471-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDES NSUN2, RNGTT, DCLRE1B POLA1 224/4885APP 4692/4885CYP46A1 3991/4885

“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.