SCHEMBL26430630

SCHEMBL26430630

O=C(NCCc1c[nH]c2ccc(I)cc12)Nc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.76
SMN1; SMN2 Q16637 5/20 0.76
POLB P06746 1/20 0.76
MEN1 O00255 6/20 0.74
KMT2A Q03164 6/20 0.74
TRPV1 Q8NER1 1/20 0.66
GOT1 P17174 7/20 0.61
LMNA P02545 1/20 0.58
ALOX15 P16050 1/20 0.58
TP53 P04637 1/20 0.56

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
SCHEMBL26430691 0.89 MAPT (0.72) MAPTSMN1; SMN2POLBMEN1KMT2A
SCHEMBL23925476 0.86 MAPT (0.76) MAPTSMN1; SMN2POLBMEN1KMT2A
SCHEMBL23925545 0.86 MAPT (0.76) MAPTSMN1; SMN2POLBMEN1KMT2A
SCHEMBL734585 0.85 MEN1 (1.00) MAPTSMN1; SMN2POLBMEN1KMT2A
SCHEMBL5343192 0.83 KMT2A (0.73) POLBMEN1KMT2ATRPV1
SCHEMBL23925504 0.79 GOT1 (0.78) MAPTSMN1; SMN2POLBMEN1KMT2A
SCHEMBL23925617 0.79 MAPT (0.87) MAPTSMN1; SMN2POLBMEN1KMT2A
SCHEMBL23925548 0.78 TSHR (0.68) MAPTSMN1; SMN2POLBMEN1KMT2A
SCHEMBL27375912 0.78 STING1 (0.56) MAPTSMN1; SMN2POLBMEN1KMT2A
SCHEMBL11355422 0.77 MAPT (0.65) MAPTSMN1; SMN2POLBMEN1KMT2A

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-20230131376-A1 ADJUVANT-ANTIBIOTIC COMBINATION AGAINST GRAM-NEGATIVE BACTERIA UNIVERSITY OF NOTRE DAME DU LAC 2023-04-27 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-20230131376-A1 ADJUVANT-ANTIBIOTIC COMBINATION AGAINST GRAM-NEGATIVE BACTERIA TLR4, TLR5, TLR1 MAPT 1718/4885SMN1; SMN2 4580/4885POLB 498/4885

“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.