SCHEMBL3931354

SCHEMBL3931354

CCCc1ccc(-c2csc(NC(=O)c3ccccc3)c2C(=O)OCC)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.67
MAPT P10636 5/20 0.67
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
ALOX12 P18054 3/20 0.67
POLB P06746 2/20 0.67
SMN1; SMN2 Q16637 3/20 0.66
PTPN1 P18031 4/20 0.65
PTPRC P08575 1/20 0.65
PTPRF P10586 1/20 0.65
PTPN2 P17706 1/20 0.65
PTPA Q15257 1/20 0.65
THRB P10828 2/20 0.64
TP53 P04637 2/20 0.64
ALDH1A1 P00352 4/20 0.63
HPGD P15428 4/20 0.63
HTT P42858 1/20 0.61
KDM4E B2RXH2 3/20 0.61
RAB9A P51151 1/20 0.60
CYP1A2 P05177 1/20 0.60

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
SCHEMBL3933219 0.93 LMNA (0.70) LMNAMAPTMEN1KMT2AALOX12
SCHEMBL21247167 0.89 LMNA (0.81) LMNAMAPTMEN1KMT2AALOX12
SCHEMBL21247385 0.87 TP53 (0.72) LMNAMAPTMEN1KMT2AALOX12
SCHEMBL3931523 0.86 PTPN1 (0.78) LMNAMAPTMEN1KMT2AALOX12
SCHEMBL3931626 0.84 LMNA (0.67) LMNAMAPTMEN1KMT2AALOX12
SCHEMBL13962634 0.82 LMNA (0.72) LMNAMAPTMEN1KMT2AALOX12
SCHEMBL21247131 0.80 PTPN1 (0.65) LMNAMAPTMEN1KMT2AALOX12
SCHEMBL21248149 0.80 HPGD (0.62) LMNAMAPTMEN1KMT2AALOX12
SCHEMBL3934240 0.79 LMNA (0.67) LMNAMAPTMEN1KMT2AALOX12
SCHEMBL13926869 0.79 MEN1 (0.58) MAPTMEN1KMT2ASMN1; SMN2THRB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069288-A1 Novel therapeutic compounds ABBVIE INC. 2009-03-12 US disclosed
US-20090069288-A1 Novel therapeutic compounds ABBVIE INC. 2009-03-12 US disclosed
US-20090069288-A1 Novel therapeutic compounds ABBVIE INC. 2009-03-12 US disclosed
WO-2009011850-A2 NOVEL THERAPEUTIC COMPOUNDS ABBOTT LABORATORIES (US) 2009-01-22 WO disclosed
WO-2009011850-A2 NOVEL THERAPEUTIC COMPOUNDS ABBOTT LABORATORIES (US) 2009-01-22 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-20090069288-A1 Novel therapeutic compounds MAP3K20, RPS6KB1, MAP3K1 LMNA 3011/4885MAPT 3755/4885MEN1 3233/4885

“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.