SCHEMBL23925617

SCHEMBL23925617

Cc1ccc(NC(=O)NCCc2c[nH]c3ccc(C)cc23)cc1

nearest known ligand 0.87

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.87
SMN1; SMN2 Q16637 3/20 0.87
POLB P06746 1/20 0.87
MTNR1A P48039 2/20 0.71
MTNR1B P49286 1/20 0.71
MEN1 O00255 4/20 0.70
KMT2A Q03164 4/20 0.70
TP53 P04637 1/20 0.67
GOT1 P17174 4/20 0.61
ALDH1A1 P00352 1/20 0.60
HPGD P15428 1/20 0.60
GFER P55789 1/20 0.59
PTGS1 P23219 1/20 0.59
PTGS2 P35354 1/20 0.59
GAA P10253 1/20 0.58
ALOX12 P18054 1/20 0.58

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
SCHEMBL23925614 0.93 MAPT (0.80) MAPTSMN1; SMN2POLBMTNR1AMTNR1B
SCHEMBL26430695 0.93 MAPT (0.83) MAPTSMN1; SMN2POLBMTNR1AMTNR1B
SCHEMBL26430691 0.91 MAPT (0.72) MAPTSMN1; SMN2POLBMTNR1AMTNR1B
SCHEMBL23925546 0.89 GOT1 (0.75) MAPTSMN1; SMN2POLBMTNR1AMTNR1B
SCHEMBL23925547 0.86 MAPT (0.78) MAPTSMN1; SMN2POLBMTNR1AMTNR1B
SCHEMBL31543697 0.83 MTNR1A (1.00) MAPTSMN1; SMN2POLBMTNR1AMTNR1B
SCHEMBL1771902 0.83 MTNR1A (1.00) MAPTSMN1; SMN2POLBMTNR1AMTNR1B
SCHEMBL23925504 0.83 GOT1 (0.78) MAPTSMN1; SMN2POLBMTNR1AMTNR1B
SCHEMBL2608951 0.81 SPR (0.77) MAPTSMN1; SMN2POLBMTNR1AMTNR1B
SCHEMBL17211923 0.81 MTNR1A (0.76) MAPTSMN1; SMN2POLBMTNR1AMTNR1B

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 4 patents. 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 claimed
WO-2021211123-A1 ADJUVANT-ANTIBIOTIC COMBINATION AGAINST GRAM-NEGATIVE BACTERIA UNIVERSITY OF NOTRE DAME DU LAC (US) 2021-10-21 WO claimed
US-20230131376-A1 ADJUVANT-ANTIBIOTIC COMBINATION AGAINST GRAM-NEGATIVE BACTERIA UNIVERSITY OF NOTRE DAME DU LAC 2023-04-27 US disclosed
WO-2021211123-A1 ADJUVANT-ANTIBIOTIC COMBINATION AGAINST GRAM-NEGATIVE BACTERIA UNIVERSITY OF NOTRE DAME DU LAC (US) 2021-10-21 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-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.