SCHEMBL20845950

SCHEMBL20845950

CON(C)C(=O)CCCN

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.47
LMNA P02545 3/20 0.41
KMT2A Q03164 3/20 0.41
THRB P10828 2/20 0.41
BLM P54132 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
TSHR P16473 2/20 0.41
GABRR3 A8MPY1 1/20 0.41
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
HDAC3 O15379 1/20 0.41
GABBR2 O75899 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRR1 P24046 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRR2 P28476 1/20 0.41
SLC6A1 P30531 1/20 0.41
GABRA5 P31644 1/20 0.41

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
SCHEMBL4805008 0.86
SCHEMBL24703880 0.86 ALDH1A1 (0.42) LMNAKMT2ATSHRALDH1A1MEN1
SCHEMBL22205611 0.86 LMNA (0.44) LMNAKMT2ATSHRALDH1A1MEN1
Hydrochloric Acid SCHEMBL6162130 0.84 MEN1 (0.35) CYP1A2LMNAKMT2ABLMNPSR1
SCHEMBL29991123 0.84 ALDH1A1 (0.41) LMNAHDAC1HDAC2HDAC6ALDH1A1
SCHEMBL4019745 0.81 PHF8 (0.39) LMNAKMT2ATSHRHDAC4HDAC6
SCHEMBL211903 0.80 ALDH1A1 (0.60) LMNAALDH1A1
SCHEMBL6541852 0.80 CAMK2A (0.39) LMNAKMT2ATSHRALDH1A1MEN1
SCHEMBL735310 0.78 ALDH1A1 (0.37) LMNAKMT2ATSHRALDH1A1MEN1
SCHEMBL4000043 0.78 ALDH1A1 (0.37) LMNAKMT2ATSHRALDH1A1MEN1

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-20230150989-A1 HERBICIDAL MALONAMIDES BASF SE (DE) 2023-05-18 US disclosed
WO-2019059132-A1 NOVEL NF-κB INHIBITOR 学校法人北里研究所 2019-03-28 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 (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-20230150989-A1 HERBICIDAL MALONAMIDES DDT, DHRS9, CA9 CYP1A2 102/4885LMNA 3455/4885KMT2A 1533/4885

“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.