SCHEMBL3361069

SCHEMBL3361069

Cc1ccccc1-c1cc(-c2ccccc2C)cc(-c2cc(-c3ccccc3C)c(-c3cc(-c4ccccc4C)cc(-c4ccccc4C)c3)cc2-c2ccccc2C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
MCL1 Q07820 1/20 0.42
TSHR P16473 2/20 0.41
ACHE P22303 1/20 0.41
TRPA1 O75762 1/20 0.41
CTSD P07339 1/20 0.41
BACE1 P56817 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
GRIA1 P42261 1/20 0.39
CACNG8 Q8WXS5 1/20 0.39

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
SCHEMBL19897390 0.90 TSHR (0.50) HTR7CA12CA1CA2CA9
SCHEMBL3360503 0.88 ESR2 (0.50) HTR7CA12CA1CA2CA9
SCHEMBL3805272 0.81 HTR7 (0.49) HTR7CA12CA1CA2CA9
SCHEMBL12999296 0.81 CYP11B1 (0.45) TSHRNPC1RAB9ASMN1; SMN2HPGD
SCHEMBL21230086 0.81 HTR7 (0.47) HTR7CA12CA1CA2CA9
SCHEMBL29628983 0.80 HTR7 (0.60) HTR7CA12CA1CA2CA9
SCHEMBL19577765 0.80 HTR7 (0.60) HTR7CA12CA1CA2CA9
SCHEMBL22299984 0.79 HTR7 (0.42) HTR7CA12CA1CA2CA9
SCHEMBL7475844 0.79 TSHR (0.44) HTR7CA12CA1CA2CA9
SCHEMBL11783057 0.79 ABL1 (0.54) HTR7CA12CA1CA2CA9

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-20100308313-A1 Organic Material Containing Oligophenylene Skeleton and Light-Emitting Device Using the Same NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY 2010-12-09 US disclosed
EP-2236485-A1 ORGANIC MATERIAL CONTAINING OLIGOPHENYLENE SKELETON AND LIGHT-EMITTING DEVICE USING THE SAME National University Corporation Nagoya University (JP) 2010-10-06 EP 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-20100308313-A1 Organic Material Containing Oligophenylene Skeleton and Light-Emitting Device Using the Same BMP2, SOST, BMP4 HTR7 3741/4885CA12 2420/4885CA1 2989/4885

“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.