SCHEMBL17963045

SCHEMBL17963045

C#Cc1cccc(C(C)=O)n1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 2/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
ACMSD Q8TDX5 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 2/20 0.36
IRAK4 Q9NWZ3 1/20 0.35
CYP1A2 P05177 1/20 0.35
P2RX7 Q99572 1/20 0.33
AHR P35869 1/20 0.33
THRB P10828 1/20 0.33
NPC1 O15118 1/20 0.33
KDM1A O60341 1/20 0.33
RAB9A P51151 1/20 0.33
GRM5 P41594 1/20 0.32

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
SCHEMBL31098054 1.00 ALDH1A1 (0.42) ALDH1A1KDM4EALOX15TSHRACMSD
SCHEMBL7931837 0.82 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
Acetic Acid SCHEMBL28168133 0.82 KDM4E (0.38) ALDH1A1KDM4EALOX15TSHRACMSD
SCHEMBL7770340 0.81 AHR (0.49) ALDH1A1KDM4EALOX15TSHRACMSD
SCHEMBL2767807 0.80 MAPT (0.48) ALDH1A1KDM4ETSHRIRAK4CYP1A2
SCHEMBL22639180 0.79 ALDH1A1 (0.41) ALDH1A1KDM4EALOX15TSHRACMSD
SCHEMBL882682 0.79 ALDH1A1 (0.38) ALDH1A1KDM4EALOX15TSHRACMSD
SCHEMBL455687 0.79 KDM4E (0.59) ALDH1A1KDM4EALOX15TSHRACMSD
SCHEMBL16046267 0.78 ALDH1A1 (0.40) ALDH1A1KDM4EALOX15TSHRACMSD
SCHEMBL29110703 0.78 ALDH1A1 (0.40) ALDH1A1KDM4EALOX15TSHRACMSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250034108-A1 SODIUM CHANNEL BLOCKERS NOVARTIS AG (CH) 2025-01-30 US disclosed
US-10828288-B2 Hydrazone derivatives for the treatment of cancer RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2020-11-10 US disclosed
US-10828288-B2 Hydrazone derivatives for the treatment of cancer RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2020-11-10 US disclosed
US-20180000806-A1 HYDRAZONE DERIVATIVES FOR THE TREATMENT OF CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-01-04 US disclosed
US-20180000806-A1 HYDRAZONE DERIVATIVES FOR THE TREATMENT OF CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-01-04 US disclosed
WO-2016123253-A1 HYDRAZNE DERIVATIVES FOR THE TREATMENT OF CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-08-04 WO disclosed
WO-2016123253-A1 HYDRAZNE DERIVATIVES FOR THE TREATMENT OF CANCER RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-08-04 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 (3 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-20250034108-A1 SODIUM CHANNEL BLOCKERS SCN5A, SCN2B, SCN1B ALDH1A1 2274/4885KDM4E 2742/4885ALOX15 3444/4885
US-20180000806-A1 HYDRAZONE DERIVATIVES FOR THE TREATMENT OF CANCER H1-3, H1-5, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ALDH1A1 665/4885KDM4E 1330/4885ALOX15 1134/4885
US-10828288-B2 Hydrazone derivatives for the treatment of cancer H1-3, H1-5, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ALDH1A1 665/4885KDM4E 1330/4885ALOX15 1134/4885

“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.