SCHEMBL3554228

SCHEMBL3554228

Cn1c(C=O)cc2cccc(Br)c21

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.36
TRIM33 Q9UPN9 1/20 0.36
BRD1 O95696 1/20 0.35
TAF1 P21675 1/20 0.35
BRPF1 P55201 1/20 0.35
ALDH1A1 P00352 3/20 0.35
CYP2A6 P11509 3/20 0.33
MDM2 Q00987 1/20 0.33
HRH4 Q9H3N8 1/20 0.31
ATM Q13315 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL1253094 0.81 TRIM24 (0.37) TRIM24TRIM33BRD1TAF1BRPF1
SCHEMBL7284956 0.79 TRIM24 (0.36) TRIM24TRIM33ALDH1A1CYP2A6HRH4
SCHEMBL5266857 0.79 AKR1C3 (0.38) ALDH1A1
SCHEMBL5266851 0.79 AKR1C3 (0.38) ALDH1A1
SCHEMBL3566855 0.76 MCL1 (0.38) BRD1TAF1BRPF1ALDH1A1HRH4
SCHEMBL18000197 0.74 CMA1 (0.37) BRD1TAF1BRPF1ALDH1A1CYP2A6
SCHEMBL17673142 0.73 BRD1 (0.35) BRD1TAF1BRPF1MDM2HRH4
SCHEMBL23714603 0.72 KDM4E (0.42) TRIM24TRIM33ALDH1A1ATM
SCHEMBL689437 0.71 MCL1 (0.56) ALDH1A1ATM
SCHEMBL21683365 0.71 GRM2 (0.40) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1852420-B1 Indole compounds for treating respiratory disorders ONO PHARMACEUTICAL CO (JP) 2012-10-17 EP disclosed
US-7728023-B2 Indole compound and use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2010-06-01 US disclosed
US-20080188532-A1 Indole Compound and Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2008-08-07 US disclosed
CN-101128424-A Indole compound and use thereof ONO PHARMACEUTICAL CO (JP) 2008-02-20 CN disclosed
EP-1852420-A1 INDOLE COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-11-07 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-20080188532-A1 Indole Compound and Use Thereof CYSLTR1, LTC4S, IDO1 TRIM24 3310/4885TRIM33 2692/4885BRD1 1341/4885

“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.