SCHEMBL23910023

SCHEMBL23910023

Nc1ccc(Br)c(-c2nnn[nH]2)c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 1/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
PTPRC P08575 2/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
HTT P42858 2/20 0.31
RAB9A P51151 2/20 0.31
APAF1 O14727 1/20 0.31
NPC1 O15118 1/20 0.31
TDP2 O95551 1/20 0.31
NSD2 O96028 1/20 0.31
LMNA P02545 1/20 0.31
PLA2G1B P04054 1/20 0.31
POLB P06746 1/20 0.31
CTSL P07711 1/20 0.31
ALOX12 P18054 1/20 0.31
PLCG1 P19174 1/20 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
SCHEMBL14217428 0.84 ALDH1A1 (0.34) MAPTSMN1; SMN2TP53MEN1KMT2A
SCHEMBL24690273 0.79 CYP3A4 (0.41) MAPTSMN1; SMN2TP53MEN1KMT2A
SCHEMBL2074429 0.79 AMY1A (0.34)
SCHEMBL31376956 0.77 CASP1 (0.38) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL12821696 0.77 CASP1 (0.38) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL2158308 0.76 CYP3A4 (0.41) MAPTSMN1; SMN2TP53MEN1KMT2A
SCHEMBL24416831 0.76 DYRK1A (0.33) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL21051813 0.74 ALDH1A1 (0.45) MAPTSMN1; SMN2TP53MEN1KMT2A
SCHEMBL30915513 0.74 DCUN1D1 (0.47) MAPTSMN1; SMN2TP53MEN1KMT2A
SCHEMBL704887 0.74 DCUN1D1 (0.47) MAPTSMN1; SMN2TP53MEN1KMT2A

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-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-10-14 US disclosed
US-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-10-14 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-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS TSLP, IL5, TRPA1 MAPT 904/4885SMN1; SMN2 1332/4885TP53 4333/4885

“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.