SCHEMBL19009818

SCHEMBL19009818

O=S(=O)(c1ccccc1)c1ccc(-c2cnc3c(c2)nc(-c2ccccc2)c2c4ccccc4c4ccccc4c32)c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
NPSR1 Q6W5P4 4/20 0.38
KDM4E B2RXH2 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CYP3A4 P08684 3/20 0.36
CYP2C19 P33261 3/20 0.36
PKM P14618 2/20 0.36
CYP2C9 P11712 2/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
GRM5 P41594 3/20 0.35
AURKA O14965 2/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
KMT2A Q03164 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
SCHEMBL19009810 0.86 HTR6 (0.36) ALDH1A1NPSR1KDM4ETDP1CYP3A4
SCHEMBL19009864 0.81 ALDH1A1 (0.36) ALDH1A1NPSR1KDM4EL3MBTL1HTT
SCHEMBL19009808 0.77 TOP1 (0.34)
SCHEMBL19009805 0.77 HTR6 (0.36) ALDH1A1NPSR1KDM4EL3MBTL1HTT
SCHEMBL19009783 0.76 ALDH1A1 (0.35) ALDH1A1NPSR1KDM4EL3MBTL1HTT
SCHEMBL19009844 0.73 KDM4E (0.36) KDM4ELMNAKMT2A
SCHEMBL17300245 0.72 TDP1 (0.41) TDP1
SCHEMBL17300247 0.72 TDP1 (0.46) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL17300244 0.71 TTK (0.39) TDP1
SCHEMBL17300238 0.71 TDP1 (0.42) ALDH1A1KDM4ETDP1LMNAPOLB

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 ALDH1A1 163/4885NPSR1 4259/4885KDM4E 3813/4885

“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.