SCHEMBL25520356

SCHEMBL25520356

Cc1ccc2c3c(cccc13)C(=O)N2CCCS(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 17/20 0.48
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
APAF1 O14727 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PKM P14618 1/20 0.43

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
SCHEMBL20864360 0.85 BRD4 (0.56) BRD4ALDH1A1MAPTSMN1; SMN2PKM
SCHEMBL14527677 0.82 BRD4 (0.55) BRD4ALDH1A1MAPTSMN1; SMN2PKM
SCHEMBL25520367 0.81 ALDH1A1 (0.47) BRD4KDM4EALDH1A1APAF1GAA
SCHEMBL20864358 0.81 ALDH1A1 (0.56) KDM4EALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL17992501 0.77 ALDH1A1 (0.71) BRD4KDM4EALDH1A1APAF1GAA
SCHEMBL30097952 0.76 HTR7 (0.56) KDM4EALDH1A1SMN1; SMN2
SCHEMBL28950254 0.76 HTR7 (0.56) KDM4EALDH1A1SMN1; SMN2
SCHEMBL918303 0.74 TDP1 (0.51) MAPTSMN1; SMN2L3MBTL1
SCHEMBL14023220 0.74 KDM4E (0.61) KDM4EALDH1A1SMN1; SMN2
SCHEMBL20864359 0.73 BRD4 (0.54) BRD4ALDH1A1MAPTSMN1; SMN2L3MBTL1

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-20230159762-A1 NIR TO SWIR FLUORESCENT COMPOUNDS FOR IMAGING AND DETECTION REVVITY HEALTH SCIENCES, INC. 2023-05-25 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-20230159762-A1 NIR TO SWIR FLUORESCENT COMPOUNDS FOR IMAGING AND DETECTION SMARCD1, SMARCE1, SMARCB1 BRD4 323/4885KDM4E 2640/4885ALDH1A1 3287/4885

“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.