SCHEMBL20667920

SCHEMBL20667920

CCCCNc1nc(C)nc2sc3c(c12)CCCC3

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.62
▸ SMN1; SMN2 Q16637 6/20 0.62
▸ HTT P42858 5/20 0.62
▸ NPSR1 Q6W5P4 4/20 0.62
▸ MEN1 O00255 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ ALDH1A1 P00352 5/20 0.55
▸ CYP1A2 P05177 2/20 0.55
▸ CYP3A4 P08684 2/20 0.55
▸ CYP2C9 P11712 2/20 0.55
▸ CYP2C19 P33261 2/20 0.55
▸ POLB P06746 2/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ CYP2D6 P10635 1/20 0.55
▸ TSHR P16473 1/20 0.55
▸ GAA P10253 2/20 0.54
▸ KDM4E B2RXH2 5/20 0.52
▸ USP2 O75604 2/20 0.52
▸ ALOX15 P16050 2/20 0.52
▸ HPGD P15428 2/20 0.52

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
SCHEMBL13164942 0.87 MAPT (0.67) MAPTSMN1; SMN2HTTNPSR1MEN1
SCHEMBL13164900 0.80 SMN1; SMN2 (0.73) MAPTSMN1; SMN2HTTNPSR1MEN1
SCHEMBL13164904 0.78 SMN1; SMN2 (0.57) MAPTSMN1; SMN2HTTNPSR1MEN1
SCHEMBL13164937 0.75 MAPT (0.62) MAPTSMN1; SMN2HTTNPSR1MEN1
SCHEMBL20667980 0.75 SMN1; SMN2 (0.53) MAPTSMN1; SMN2HTTNPSR1MEN1
SCHEMBL540857 0.75 CSNK2A2 (0.64) MAPTSMN1; SMN2HTTMEN1ALDH1A1
SCHEMBL13164915 0.74 MAPT (0.55) MAPTSMN1; SMN2HTTNPSR1MEN1
SCHEMBL14115087 0.74 MEN1 (0.53) MAPTSMN1; SMN2HTTNPSR1MEN1
SCHEMBL16281245 0.73 MEN1 (0.58) MAPTSMN1; SMN2HTTNPSR1MEN1
SCHEMBL19523723 0.72 ALDH1A1 (0.62) MAPTSMN1; SMN2HTTMEN1KMT2A

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-20220117968-A1 THIENO[2,3-D)PYRIMIDINES AND BENZOFURO(3,2-D)PYRIMIDINES AS ANTIMICROBIAL AGENTS SAINT LOUIS UNIVERSITY 2022-04-21 — — US disclosed
WO-2019018359-A1 THIENO[2,3-D)PYRIMIDINES AND BENZOFURO(3,2-D)PYRIMIDINES AS ANTIMICROBIAL AGENTS SAINT LOUIS UNIVERSITY (US) 2019-01-24 — — 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-20220117968-A1 THIENO[2,3-D)PYRIMIDINES AND BENZOFURO(3,2-D)PYRIMIDINES AS ANTIMICROBIAL AGENTS TYMS, DPYD, UMPS MAPT 2674/4885SMN1; SMN2 3418/4885HTT 4107/4885

“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.

Send feedback