SCHEMBL20095396

SCHEMBL20095396

O=C(/C=C/c1cccnc1)NCCCCC1CCN(C(=O)c2ccccc2O)CC1

nearest known ligand 0.79

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 18/20 0.79
CYP3A4 P08684 1/20 0.79
CYP2C9 P11712 1/20 0.79
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
HDAC9 Q9UKV0 1/20 0.48
HDAC5 Q9UQL6 1/20 0.48
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL20095467 0.90 NAMPT (0.78) NAMPTCYP3A4CYP2C9HDAC3HDAC4
SCHEMBL22654247 0.90 NAMPT (0.78) NAMPTCYP3A4CYP2C9HDAC3HDAC4
Daporinad SCHEMBL156944 0.88 NAMPT (1.00) NAMPTCYP3A4CYP2C9HDAC3HDAC4
Daporinad SCHEMBL31181445 0.88 NAMPT (1.00) NAMPTCYP3A4CYP2C9HDAC3HDAC4
Daporinad SCHEMBL82367 0.88 NAMPT (1.00) NAMPTCYP3A4CYP2C9HDAC3HDAC4
Daporinad SCHEMBL29635857 0.88 NAMPT (1.00) NAMPTCYP3A4CYP2C9HDAC3HDAC4
Daporinad SCHEMBL82368 0.88 NAMPT (1.00) NAMPTCYP3A4CYP2C9HDAC3HDAC4
Daporinad SCHEMBL23924298 0.88 NAMPT (0.98) NAMPTCYP3A4CYP2C9HDAC3HDAC4
SCHEMBL3458354 0.88 NAMPT (0.98) NAMPTCYP3A4CYP2C9HDAC3HDAC4
SCHEMBL3458355 0.88 NAMPT (0.98) NAMPTCYP3A4CYP2C9HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240293554-A1 QUATERNIZED NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITOR CONJUGATES SEAGEN INC (US) 2024-09-05 US disclosed
US-11931414-B2 Quaternized nicotinamide adenine dinucleotide salvage pathway inhibitor conjugates SEAGEN INC. (US) 2024-03-19 US disclosed
US-20240016953-A1 TARGETED DELIVERY OF NICOTINAMINDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS SEAGEN INC (US) 2024-01-18 US disclosed
US-20240016953-A1 TARGETED DELIVERY OF NICOTINAMINDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS SEAGEN INC (US) 2024-01-18 US disclosed
US-20240016953-A1 TARGETED DELIVERY OF NICOTINAMINDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS SEAGEN INC (US) 2024-01-18 US disclosed
US-11638762-B2 Targeted delivery of nicotinamide adenine dinucleotide salvage pathway inhibitors SEAGEN INC. (US) 2023-05-02 US disclosed
US-11638762-B2 Targeted delivery of nicotinamide adenine dinucleotide salvage pathway inhibitors SEAGEN INC. (US) 2023-05-02 US disclosed
US-11638762-B2 Targeted delivery of nicotinamide adenine dinucleotide salvage pathway inhibitors SEAGEN INC. (US) 2023-05-02 US disclosed
US-20200197524-A1 QUATERNIZED NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITOR CONJUGATES SEATTLE GENETICS, INC. (US) 2020-06-25 US disclosed
US-20200197524-A1 QUATERNIZED NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITOR CONJUGATES SEATTLE GENETICS, INC. (US) 2020-06-25 US disclosed
CN-110799217-A Quaternized nicotinamide adenine dinucleotide salvage pathway inhibitor conjugates 西雅图基因公司 2020-02-14 CN disclosed
US-20190314519-A1 TARGETED DELIVERY OF NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS SEATTLE GENETICS, INC. (US) 2019-10-17 US disclosed
US-20190314519-A1 TARGETED DELIVERY OF NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS SEATTLE GENETICS, INC. (US) 2019-10-17 US disclosed
CN-109843334-A The targeted delivery of nicotinamide adenine dinucleotide remedial pathway inhibitor 西雅图基因公司 2019-06-04 CN disclosed
WO-2018075600-A1 TARGETED DELIVERY OF NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS SEATTLE GENETICS, INC. (US) 2018-04-26 WO 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 (6 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-11931414-B2 Quaternized nicotinamide adenine dinucleotide salvage pathway inhibitor conjugates NAMPT, NNMT, NADK NAMPT 1/4885CYP3A4 4804/4885CYP2C9 4269/4885
US-20240016953-A1 TARGETED DELIVERY OF NICOTINAMINDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS NAMPT, NAPRT, NNMT NAMPT 1/4885CYP3A4 4861/4885CYP2C9 4684/4885
US-20200197524-A1 QUATERNIZED NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITOR CONJUGATES NAMPT, NNMT, NADK NAMPT 1/4885CYP3A4 4804/4885CYP2C9 4269/4885
US-20240293554-A1 QUATERNIZED NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITOR CONJUGATES NAMPT, NNMT, NADK NAMPT 1/4885CYP3A4 4804/4885CYP2C9 4269/4885
US-20190314519-A1 TARGETED DELIVERY OF NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS NAMPT, NME4, NNMT NAMPT 1/4885CYP3A4 4869/4885CYP2C9 4851/4885
US-11638762-B2 Targeted delivery of nicotinamide adenine dinucleotide salvage pathway inhibitors NAMPT, NME4, NNMT NAMPT 1/4885CYP3A4 4869/4885CYP2C9 4851/4885

“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.