SCHEMBL20095484

SCHEMBL20095484

Nc1cccc(C(=O)N2CCC(CCCCNc3c(Nc4ccncc4)c(=O)c3=O)CC2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 13/20 0.45
MAPKAPK2 P49137 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CCR3 P51677 1/20 0.41
MGLL Q99685 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
CHEK1 O14757 1/20 0.38
DAPK3 O43293 1/20 0.38
ROCK2 O75116 1/20 0.38

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
SCHEMBL2552281 0.89 NAMPT (0.56) NAMPTMAPKAPK2CYP3A4CYP2C9HDAC3
SCHEMBL25131015 0.88 NAMPT (0.44) NAMPTMAPKAPK2CYP3A4CYP2C9MGLL
SCHEMBL25130458 0.86 MAPKAPK2 (0.44) NAMPTMAPKAPK2CYP3A4CYP2C9DAPK3
SCHEMBL20095463 0.84 NAMPT (0.43) NAMPTMAPKAPK2CYP3A4CYP2C9
SCHEMBL27008595 0.82 MAPKAPK2 (0.44) NAMPTMAPKAPK2CYP3A4CYP2C9HDAC1
SCHEMBL25130473 0.78 NAMPT (0.47) NAMPTCYP3A4CYP2C9
SCHEMBL20095460 0.77 NAMPT (0.46) NAMPTCYP3A4CYP2C9CCR3MGLL
SCHEMBL21461996 0.77 GPR119 (0.54)
SCHEMBL28376997 0.77 NAMPT (0.39) NAMPTCYP3A4CYP2C9HDAC1PRKACA
SCHEMBL2549126 0.76 SIGMAR1 (0.51) MAPKAPK2HDAC1

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 13 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-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
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 1/4885MAPKAPK2 790/4885CYP3A4 4804/4885
US-20240016953-A1 TARGETED DELIVERY OF NICOTINAMINDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS NAMPT, NAPRT, NNMT NAMPT 1/4885MAPKAPK2 892/4885CYP3A4 4861/4885
US-20200197524-A1 QUATERNIZED NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITOR CONJUGATES NAMPT, NNMT, NADK NAMPT 1/4885MAPKAPK2 790/4885CYP3A4 4804/4885
US-20240293554-A1 QUATERNIZED NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITOR CONJUGATES NAMPT, NNMT, NADK NAMPT 1/4885MAPKAPK2 790/4885CYP3A4 4804/4885
US-20190314519-A1 TARGETED DELIVERY OF NICOTINAMIDE ADENINE DINUCLEOTIDE SALVAGE PATHWAY INHIBITORS NAMPT, NME4, NNMT NAMPT 1/4885MAPKAPK2 740/4885CYP3A4 4869/4885
US-11638762-B2 Targeted delivery of nicotinamide adenine dinucleotide salvage pathway inhibitors NAMPT, NME4, NNMT NAMPT 1/4885MAPKAPK2 740/4885CYP3A4 4869/4885

“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.