SCHEMBL2854780

SCHEMBL2854780

CCN(CC)C(=O)c1cccc(C(N)=O)c1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.67
TDP1 Q9NUW8 1/20 0.67
ALDH1A1 P00352 4/20 0.54
LMNA P02545 3/20 0.54
TSHR P16473 1/20 0.54
PARP1 P09874 5/20 0.52
HSP90AA1 P07900 5/20 0.51
HSP90AB1 P08238 5/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MAPT P10636 1/20 0.50
CHEK2 O96017 1/20 0.49
CYP1A2 P05177 1/20 0.47
BLM P54132 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
SCHEMBL7406512 0.91 HPGD (0.79) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL2206850 0.86 TP53 (0.51) HPGDTDP1ALDH1A1PARP1
Hydrochloric Acid SCHEMBL3355966 0.85 TP53 (0.50) HPGDTDP1ALDH1A1PARP1
Hydrochloric Acid SCHEMBL3352609 0.85 TP53 (0.50) HPGDTDP1ALDH1A1PARP1
SCHEMBL7314304 0.84 HSP90AA1 (0.54) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL29386132 0.84 HPGD (0.69) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL2566192 0.84 HPGD (0.69) HPGDTDP1ALDH1A1LMNATSHR
SCHEMBL20881904 0.83 HPGD (0.48) HPGDTDP1ALDH1A1LMNATSHR
Acetic Acid SCHEMBL6139768 0.82 TP53 (0.47) HPGDTDP1ALDH1A1PARP1
SCHEMBL6675903 0.82 HPGD (0.56) HPGDTDP1ALDH1A1TSHRPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed
CN-105530812-B Insect repellent and insect repelling method 理研香料控股株式会社 2020-01-14 CN disclosed
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP disclosed
US-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES ICAGEN, INC. (US) 2008-03-13 US disclosed
US-7223782-B2 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2007-05-29 US disclosed
US-20050049237-A1 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2005-03-03 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 (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-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES SCN3A, TRPV3, HCN3 HPGD 1358/4885TDP1 3631/4885ALDH1A1 3589/4885
US-20050049237-A1 Pyrazole-amides and -sulfonamides SCN3A, TRPV3, HCN3 HPGD 1358/4885TDP1 3631/4885ALDH1A1 3589/4885

“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.