SCHEMBL21234722

SCHEMBL21234722

O=Cc1cc2sc3cc(N4CCCC4)sc3c2s1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.39
SMN1; SMN2 Q16637 4/20 0.35
MAPT P10636 2/20 0.35
PSMD14 O00487 1/20 0.35
KMT2A Q03164 1/20 0.35
TRIM24 O15164 1/20 0.33
TRIM33 Q9UPN9 1/20 0.33
ALDH1A3 P47895 3/20 0.33
CYP2A6 P11509 2/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 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
SCHEMBL21234744 0.86 PRKDC (0.41) ALDH1A1SMN1; SMN2MAPTKMT2AALDH1A3
SCHEMBL7250022 0.80 CYP2A6 (0.45) CYP2A6
SCHEMBL4570581 0.69 CYP2A6 (0.39) CYP2A6
SCHEMBL17385341 0.68 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL8702014 0.67 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2MAPTPSMD14KMT2A
SCHEMBL22829572 0.67 CYP2A6 (0.39) CYP2A6
SCHEMBL32676141 0.66 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2MAPTPSMD14KMT2A
SCHEMBL1260268 0.66 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2MAPTPSMD14KMT2A
SCHEMBL21234924 0.66 CYP2A6 (0.35) CYP2A6
SCHEMBL13084791 0.64 CYP2A6 (0.56) ALDH1A1MAPTCYP2A6

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-11365203-B2 Fluorescent dye and preparation method and use thereof FLUORESCENCE DIAGNOSIS (SHANGHAI) BIOTECH COMPANY LTD. (CN) 2022-06-21 US disclosed
US-20190241584-A1 FLUORESCENT DYE AND PREPARATION METHOD AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2019-08-08 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 (2 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-20190241584-A1 FLUORESCENT DYE AND PREPARATION METHOD AND USE THEREOF DNASE1, POLRMT, DCLRE1B ALDH1A1 422/4885SMN1; SMN2 1668/4885MAPT 2048/4885
US-11365203-B2 Fluorescent dye and preparation method and use thereof DNASE1, POLRMT, DCLRE1B ALDH1A1 422/4885SMN1; SMN2 1668/4885MAPT 2048/4885

“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.