SCHEMBL19009847

SCHEMBL19009847

O=S(=O)(c1ccccc1)c1c2ccccc2c(-c2nc3c4ccccc4c4ccccc4c3c3ccccc23)c2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.36
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 3/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TYMS P04818 1/20 0.34
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA13 Q8N1Q1 1/20 0.33
KDM4E B2RXH2 2/20 0.33
FFAR2 O15552 1/20 0.33
MAPT P10636 1/20 0.33
CYP19A1 P11511 1/20 0.32
CYP2C9 P11712 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL19009856 0.87 MET (0.38) HTR6ALDH1A1TDP1MET
SCHEMBL19009850 0.87 HTR6 (0.35) HTR6HTTL3MBTL1ALDH1A1TYMS
SCHEMBL19009791 0.82 FFAR2 (0.35) HTTL3MBTL1ALDH1A1CA12CA1
SCHEMBL19009848 0.80 HTR6 (0.37) HTR6HTTL3MBTL1ALDH1A1HSD17B10
SCHEMBL19009792 0.80 FFAR2 (0.35) HTR6HTTL3MBTL1ALDH1A1TDP1
SCHEMBL19009779 0.77 FFAR2 (0.35) HTTL3MBTL1ALDH1A1KDM4EFFAR2
SCHEMBL19009862 0.75 HTR6 (0.38) HTR6HTTL3MBTL1ALDH1A1TYMS
SCHEMBL19009812 0.71 NPSR1 (0.36) TYMS
SCHEMBL19009865 0.70 TDP1 (0.36) HTR6HTTL3MBTL1ALDH1A1TDP1
SCHEMBL19009846 0.70 TDP1 (0.35) HTR6HTTL3MBTL1ALDH1A1TDP1

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 3859/4885HTT 3766/4885L3MBTL1 1872/4885

“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.