SCHEMBL16787342

SCHEMBL16787342

Clc1ccc(-c2cccc3c2Sc2ccccc2S3)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.47
▸ PTGS2 P35354 3/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ CYP1A2 P05177 1/20 0.40
▸ SLC6A4 P31645 1/20 0.37
▸ SLC6A3 Q01959 1/20 0.37
▸ BCHE P06276 3/20 0.36
▸ ACHE P22303 1/20 0.36
▸ NOX1 Q9Y5S8 1/20 0.36
▸ ATM Q13315 2/20 0.35
▸ PRKDC P78527 2/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ PIK3CB P42338 1/20 0.35
▸ MTOR P42345 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ TSHR P16473 1/20 0.34

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
SCHEMBL16165379 0.85 ALOX5 (0.50) ALOX5PTGS2CYP1A2BCHEATM
SCHEMBL10985315 0.84 ALOX5 (0.53) ALOX5PTGS2ATMPRKDCPIK3CA
SCHEMBL16166953 0.83 ALOX5 (0.53) ALOX5PTGS2PTGS1CYP1A2SLC6A3
SCHEMBL16787347 0.81 ALOX5 (0.47) ALOX5SLC6A4BCHEACHENOX1
SCHEMBL30301299 0.81 ALOX5 (0.47) ALOX5SLC6A4SLC6A3ATMPRKDC
SCHEMBL23555385 0.81 ALOX5 (0.47) ALOX5BCHEATMPRKDCPIK3CA
SCHEMBL27866829 0.81 ALOX5 (0.65) ALOX5ATMALDH1A1HSD17B10HPGD
SCHEMBL17474342 0.80 ALOX5 (0.58) ALOX5PTGS2PTGS1CYP1A2SLC6A3
SCHEMBL17485918 0.80 ALOX5 (0.46) ALOX5PTGS2ATMPRKDCPIK3CA
SCHEMBL23555387 0.80 ALOX5 (0.46) ALOX5BCHEATMPRKDCPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115745842-B Method for synthesizing aromatic carbamate by photocatalysis 华南理工大学 2023-10-20 — — CN disclosed
CN-115745842-A Method for synthesizing aromatic carbamate through photocatalysis 华南理工大学 2023-03-07 — — CN disclosed
US-20150162542-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE SAMSUNG SDI CO., LTD. (KR) 2015-06-11 — — US disclosed
US-20150162542-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE SAMSUNG SDI CO., LTD. (KR) 2015-06-11 — — 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-20150162542-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE AOX1, ODC1, OR51E2 ALOX5 344/4885PTGS2 2569/4885PTGS1 1452/4885

“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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