SCHEMBL12899486

SCHEMBL12899486

COc1ccc2c(c1)c1cccc3c4cc5c6cc7ccc(C)cc7cc6c6cccc(c4cc2c13)c65

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.43
▸ MTNR1A P48039 2/20 0.40
▸ CYP2A6 P11509 4/20 0.40
▸ CYP1A2 P05177 4/20 0.40
▸ TDP1 Q9NUW8 2/20 0.38
▸ HTR2A P28223 1/20 0.37
▸ CYP11B1 P15538 1/20 0.36
▸ CYP11B2 P19099 1/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ MAPT P10636 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ L3MBTL1 Q9Y468 3/20 0.36
▸ LMNA P02545 1/20 0.36
▸ FLT3 P36888 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ NPC1 O15118 1/20 0.36

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
SCHEMBL12927505 0.91 CYP1A2 (0.48) MTNR1ACYP2A6CYP1A2HTR2ACYP11B1
SCHEMBL12589223 0.91 ACHE (0.48) ACHEMTNR1ATDP1KDM4EALDH1A1
SCHEMBL12646378 0.86 MAPT (0.46) ACHEMTNR1ACYP2A6CYP1A2TDP1
SCHEMBL12589226 0.82 ACHE (0.40) ACHETDP1KDM4EALDH1A1MAPT
SCHEMBL17552367 0.79 ACHE (0.52) ACHECYP2A6CYP1A2TDP1KDM4E
SCHEMBL10023273 0.79 ACHE (0.52) ACHECYP2A6CYP1A2TDP1KDM4E
SCHEMBL17552365 0.79 ACHE (0.52) ACHECYP2A6CYP1A2TDP1KDM4E
SCHEMBL16108132 0.77 MAPT (0.52) ACHEMTNR1ACYP2A6CYP1A2TDP1
SCHEMBL8840938 0.77 ACHE (0.54) ACHEKDM4EALDH1A1MAPTHPGD
SCHEMBL12646381 0.76 MAPT (0.41) ACHEMTNR1ATDP1KDM4EALDH1A1

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-8586207-B2 Fused polycyclic compound and organic light emitting device having the compound CANON KABUSHIKI KAISHA (JP) 2013-11-19 — — US disclosed
US-20110024737-A1 FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2011-02-03 — — 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-20110024737-A1 FUSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND MAP1LC3C, MAP1LC3A, MAP1LC3B ACHE 1252/4885MTNR1A 3505/4885CYP2A6 2219/4885

“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.

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