SCHEMBL16666041

SCHEMBL16666041

Brc1cccc2c1c1ccccc1n2-c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.39
▸ CNR1 P21554 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ GSK3A P49840 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTR3E A5X5Y0 1/20 0.37
▸ HTR3B O95264 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ NCF1 P14598 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ HTR1D P28221 1/20 0.37
▸ HTR1B P28222 1/20 0.37
▸ HTR2A P28223 1/20 0.37

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
SCHEMBL21234348 0.93 TDP1 (0.41) CNR2CNR1TDP1GSK3AGSK3B
SCHEMBL6569207 0.86 TDP1 (0.43) CNR2CNR1TDP1GSK3AGSK3B
SCHEMBL22213918 0.85 TDP1 (0.38) CNR2CNR1TDP1GSK3AGSK3B
SCHEMBL19849245 0.84 ALDH1A1 (0.43) CNR2CNR1TDP1GSK3AGSK3B
SCHEMBL19163146 0.83 CYP2A6 (0.39) CNR2CNR1TDP1POLBALDH1A1
SCHEMBL20149431 0.83 POLB (0.47) CNR2CNR1TDP1GSK3AGSK3B
SCHEMBL29625640 0.82 TDP1 (0.41) CNR2CNR1TDP1GSK3AGSK3B
SCHEMBL19163665 0.82 PDE7A (0.42) CNR2TDP1ALDH1A1NPC1TSHR
SCHEMBL19163348 0.82 PDE7A (0.41) ALDH1A1CYP1A2KDM4ELMNAPDE7A
SCHEMBL490291 0.82 ALDH1A1 (0.50) CNR2CNR1TDP1GSK3AGSK3B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230232708-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-20 — — US disclosed
US-20230232708-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-20 — — US disclosed
WO-2015056965-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2015-04-23 — — WO 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-20230232708-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME CRY1, SLC1A2, ASIC1 CNR2 1809/4885CNR1 2080/4885TDP1 2000/4885

“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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