SCHEMBL6189858

SCHEMBL6189858

CS(=O)(=O)c1ccc(Cn2ccc3ccccc32)cc1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.60
HDAC1 Q13547 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC10 Q969S8 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
HDAC9 Q9UKV0 1/20 0.55
KMT2A Q03164 2/20 0.54
PLAU P00749 1/20 0.54
PTGS2 P35354 1/20 0.52
HTT P42858 1/20 0.51
POLB P06746 1/20 0.48
CDK4 P11802 4/20 0.47
CCND1 P24385 4/20 0.47
MGLL Q99685 1/20 0.46
ALDH1A1 P00352 1/20 0.46
PTGDR2 Q9Y5Y4 2/20 0.45
DRD2 P14416 1/20 0.44
TBXA2R P21731 1/20 0.44

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
SCHEMBL30185514 0.87 HTR6 (0.59) HTR6HDAC1HDAC2HDAC10HDAC8
SCHEMBL30241454 0.84 HTR6 (0.49) HTR6HDAC1HDAC2HDAC10HDAC8
SCHEMBL19476152 0.82 NPC1 (0.54) HTR6HDAC1HDAC2HDAC10HDAC8
SCHEMBL6086610 0.81 PTGS2 (0.52) HTR6HDAC1HDAC2HDAC8HDAC6
SCHEMBL6086826 0.80 PTGS2 (0.51) HDAC1HDAC2HDAC10HDAC8HDAC6
SCHEMBL257765 0.79 HTR6 (0.70) HTR6HDAC1HDAC2HDAC10HDAC8
SCHEMBL2580966 0.79 HTR6 (0.70) HTR6HDAC1HDAC2HDAC10HDAC8
SCHEMBL31021 0.78 HTR6 (0.73) HTR6HDAC1HDAC2HDAC10HDAC8
SCHEMBL29509279 0.78 HTR6 (0.73) HTR6HDAC1HDAC2HDAC10HDAC8
SCHEMBL29459650 0.77 HTR6 (0.72) HTR6HDAC1HDAC2HDAC10HDAC8

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-1244652-B1 2-(1H-INDOL-3-YL)-2-OXO-ACETAMIDES WITH ANTITUMOR ACTIVITY CELL THERAPEUTICS EUROPE SRL (IT) 2005-08-24 EP disclosed
US-6753342-B2 ANTICARCINOGENIC AGENTS FOR LUNG AND COLON CANCER TREATMENT NOVUSPHARMA S.P.A. (IT) 2004-06-22 US disclosed
US-20030158153-A1 2-(1h-indol-3-yl)-2-oxo-acetamides containing a thiophene or furan ring; anticarcinogenic agents particular against solid tumors of colon and lung NOVUSPHARMA S.P.A. (IT) 2003-08-21 US disclosed
EP-1244652-A1 2-(1H-INDOL-3-YL)-2-OXO-ACETAMIDES WITH ANTITUMOR ACTIVITY Cell Therapeutics Europe S.R.L. (IT) 2002-10-02 EP disclosed
WO-2001047916-A1 2-(1H-INDOL-3-YL)-2-OXO-ACETAMIDES WITH ANTITUMOR ACTIVITY NOVUSPHARMA S.P.A. (IT) 2001-07-05 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-20030158153-A1 2-(1h-indol-3-yl)-2-oxo-acetamides containing a thiophene or furan ring; anticarcinogenic agents particular against solid tumors of colon and lung IDO2, IDO1, TXNRD2 HTR6 2619/4885HDAC1 135/4885HDAC2 147/4885

“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.