SCHEMBL17880371

SCHEMBL17880371

Cc1ccc(N(c2ccc3ccccc3c2)c2ccc3ccc4c(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)ccc5ccc2c3c54)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CYP2A6 P11509 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CYP1A2 P05177 1/20 0.30

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
SCHEMBL17880301 0.95 HTT (0.33) L3MBTL1HTTNPSR1CYP2A6TDP1
SCHEMBL17880299 0.93
SCHEMBL17880285 0.88 L3MBTL1 (0.36) L3MBTL1HTTNPSR1CYP2A6TDP1
SCHEMBL17880310 0.87 CYP1A2 (0.34) CYP2A6ALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL17880274 0.86 ALDH1A1 (0.34) L3MBTL1CYP2A6TDP1ALDH1A1CYP3A4
SCHEMBL12856443 0.86 L3MBTL1 (0.44) L3MBTL1HTTNPSR1CYP2A6TDP1
SCHEMBL17880300 0.85
SCHEMBL17880272 0.85
SCHEMBL17880369 0.85
SCHEMBL10053535 0.83 L3MBTL1 (0.43) L3MBTL1HTTNPSR1CYP2A6TDP1

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-20160190450-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190450-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 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-20160190450-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 L3MBTL1 1420/4885HTT 2521/4885NPSR1 4226/4885

“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.