SCHEMBL29912733

SCHEMBL29912733

CCNc1cc2c(c3ccccc13)Nc1ccc(N(CC)CC)cc1S2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.33
NOX1 Q9Y5S8 3/20 0.32
RPS6KA2 Q15349 1/20 0.32
GAA P10253 5/20 0.31
MAPT P10636 4/20 0.31
HTT P42858 3/20 0.31
MAPK1 P28482 2/20 0.31
TDP1 Q9NUW8 3/20 0.31
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
THRB P10828 1/20 0.31
ALOX15 P16050 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CDK2 P24941 1/20 0.31
MEN1 O00255 4/20 0.31
KMT2A Q03164 4/20 0.31

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
SCHEMBL1133892 1.00 IDO1 (0.33) IDO1NOX1RPS6KA2GAAMAPT
SCHEMBL29565964 1.00 IDO1 (0.33) IDO1NOX1RPS6KA2GAAMAPT
Hydrochloric Acid SCHEMBL498746 0.99 GAA (0.33) IDO1NOX1RPS6KA2GAAMAPT
Hydrochloric Acid SCHEMBL20994607 0.99 GAA (0.33) IDO1NOX1RPS6KA2GAAMAPT
SCHEMBL31086299 0.87 SNCA (0.31) SNCA
Hydrochloric Acid SCHEMBL29920895 0.86 KDM4E (0.31) GAAMAPTHTTTDP1LMNA
Hydrochloric Acid SCHEMBL6806923 0.86 KDM4E (0.31) GAAMAPTHTTTDP1LMNA
SCHEMBL1769919 0.83 MEN1 (0.36) NOX1MAPTTDP1LMNAKDM4E
SCHEMBL7209663 0.78 MAPT (0.33) NOX1GAAMAPTTDP1MEN1
SCHEMBL4934602 0.77 MAPT (0.35) IDO1RPS6KA2GAAMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11384033-B2 Compositions with improved urease-inhibiting effect comprising (thio)phosphoric acid triamide and further compounds such as amines and colorants BASF SE (DE) 2022-07-12 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 (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-11384033-B2 Compositions with improved urease-inhibiting effect comprising (thio)phosphoric acid triamide and further compounds such as amines and colorants SLC14A1, XDH, PNP IDO1 660/4885NOX1 1146/4885RPS6KA2 813/4885

“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.