SCHEMBL19009846

SCHEMBL19009846

O=S(=O)(c1ccccc1)c1c2ccccc2c(-c2ccc3c(c2)nc(-c2ccccc2)c2c4ccccc4c4ccccc4c32)c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 1/20 0.33
FFAR2 O15552 1/20 0.33
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
DHODH Q02127 3/20 0.32
HTR6 P50406 2/20 0.32
HTT P42858 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ABCB1 P08183 1/20 0.32
ABCC1 P33527 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
SCHEMBL17300245 0.85 TDP1 (0.41) TDP1DHODHHTR6ABCB1ABCC1
SCHEMBL17300244 0.84 TTK (0.39) TDP1
SCHEMBL17300247 0.83 TDP1 (0.46) TDP1ALDH1A1GAAKDM4ELMNA
SCHEMBL19009848 0.82 HTR6 (0.37) TDP1ALDH1A1GAAKDM4ELMNA
SCHEMBL19009865 0.82 TDP1 (0.36) TDP1ALDH1A1GAAKDM4EHPGD
SCHEMBL19009791 0.81 FFAR2 (0.35) ALDH1A1GAAKDM4EHPGDFFAR2
SCHEMBL19009810 0.81 HTR6 (0.36) TDP1ALDH1A1KDM4ELMNAHTR6
SCHEMBL17300234 0.80 HTR6 (0.42) TDP1ALDH1A1GAALMNADHODH
SCHEMBL17300240 0.80 TDP1 (0.40) TDP1LMNADHODHHTR6ABCB1
SCHEMBL19009863 0.80 HSD11B1 (0.34) TDP1DHODHHTR6

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 TDP1 2848/4885ALDH1A1 163/4885GAA 3542/4885

“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.