SCHEMBL20173174

SCHEMBL20173174

O=S(O)c1ccc(N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
CRHBP P24387 1/20 0.44
ATM Q13315 1/20 0.44
CRHR2 Q13324 1/20 0.44
TLR9 Q9NR96 1/20 0.44
NPSR1 Q6W5P4 2/20 0.38
GLA P06280 1/20 0.36
TSHR P16473 1/20 0.36
HPGD P15428 1/20 0.34

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
SCHEMBL24672237 0.92 MAPT (0.41) ALDH1A1L3MBTL1TDP1KDM4ECYP1A2
SCHEMBL21574906 0.90 ALDH1A1 (0.38) ALDH1A1L3MBTL1TDP1KDM4ECYP1A2
SCHEMBL18884676 0.85 ALDH1A1 (0.40) ALDH1A1L3MBTL1TDP1KDM4ECYP1A2
SCHEMBL49328 0.78
SCHEMBL10663817 0.78 HPGD (0.43) ALDH1A1L3MBTL1TDP1CYP1A2CYP3A4
SCHEMBL16674608 0.78
SCHEMBL9175 0.78
SCHEMBL1023085 0.76 HPGD (0.41) ALDH1A1L3MBTL1TDP1CYP1A2CYP3A4
SCHEMBL11298939 0.76 HPGD (0.41) ALDH1A1L3MBTL1TDP1CYP1A2CYP3A4
SCHEMBL1022859 0.76 HPGD (0.41) ALDH1A1L3MBTL1TDP1CYP1A2CYP3A4

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-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 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-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME CRY1, CRY2, OR10J3 ALDH1A1 87/4885L3MBTL1 349/4885TDP1 3519/4885

“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.