SCHEMBL26324037

SCHEMBL26324037

COc1ccc(CNC(C)=S)c(OC)c1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.65
ALDH1A1 P00352 4/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
TAS1R3 Q7RTX0 2/20 0.52
TAS1R1 Q7RTX1 2/20 0.52
TSHR P16473 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HPGD P15428 2/20 0.51
GAA P10253 1/20 0.51
PKM P14618 1/20 0.51
HTT P42858 1/20 0.51
QPCT Q16769 1/20 0.51
POLB P06746 1/20 0.49
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48

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
SCHEMBL2226834 0.86 APLNR (0.63) APLNRALDH1A1SMN1; SMN2TDP1TAS1R3
SCHEMBL20496920 0.84 APLNR (0.61) APLNRALDH1A1SMN1; SMN2TDP1TAS1R3
SCHEMBL25647860 0.84 APLNR (0.65) APLNRALDH1A1TAS1R3TAS1R1TSHR
SCHEMBL10141758 0.84 APLNR (0.65) APLNRALDH1A1TAS1R3TAS1R1TSHR
SCHEMBL18415441 0.82 TAS1R3 (0.67) APLNRALDH1A1TAS1R3TAS1R1TSHR
SCHEMBL933063 0.81 APLNR (0.76) APLNRALDH1A1TAS1R3TAS1R1TSHR
SCHEMBL4739573 0.81 APLNR (0.56) APLNRALDH1A1SMN1; SMN2TDP1TAS1R3
SCHEMBL2261220 0.81 APLNR (0.65) APLNRALDH1A1TAS1R3TAS1R1TSHR
SCHEMBL29209631 0.80 APLNR (0.59) APLNRALDH1A1TAS1R3TAS1R1TSHR
SCHEMBL4739043 0.80 APLNR (0.55) APLNRALDH1A1SMN1; SMN2TDP1TAS1R3

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-11766435-B2 N3-substituted iminopyrimidinones as antimalarial agents MERCK SHARP & DOHME LLC (US) 2023-09-26 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-11766435-B2 N3-substituted iminopyrimidinones as antimalarial agents CTSL, ANPEP, PRSS1 APLNR 710/4885ALDH1A1 2013/4885SMN1; SMN2 3149/4885

“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.