SCHEMBL19009857

SCHEMBL19009857

O=S(=O)(c1ccccc1)c1ccc(-c2nc3c4ccccc4c4ccccc4c3c3c2ccc2ccccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
ABCB1 P08183 1/20 0.34
ABCC1 P33527 1/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HPRT1 P00492 1/20 0.33

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
SCHEMBL17034921 0.83 HTR6 (0.39) HTR6CA12CA1CA2CA9
SCHEMBL19009850 0.82 HTR6 (0.35) HTR6MEN1KMT2AALDH1A1HTT
SCHEMBL19009696 0.81 MEN1 (0.46) MEN1MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL19009879 0.80 HPRT1 (0.33) ALDH1A1HPRT1
SCHEMBL17914971 0.77 MEN1 (0.43) MEN1MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL17300234 0.75 HTR6 (0.42) HTR6CA12CA1CA2CA9
SCHEMBL17914972 0.74 MEN1 (0.43) MEN1MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL19009695 0.74 CYP11B1 (0.46) MEN1MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL19009791 0.73 FFAR2 (0.35) CA12CA1CA2CA9ABCB1
SCHEMBL19009783 0.73 ALDH1A1 (0.35) HTR6MAPTALDH1A1HTTL3MBTL1

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-20170179407-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 US disclosed
US-20170179407-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 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-20170179407-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 HTR6 3859/4885CA12 1178/4885CA1 1325/4885

“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.