SCHEMBL6085455

SCHEMBL6085455

CCc1cccc2ccn(Cc3ccc(Cl)cc3)c12

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.47
PTGER4 P35408 2/20 0.44
PTGER2 P43116 1/20 0.44
MAPT P10636 2/20 0.43
POLB P06746 2/20 0.43
TP53 P04637 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP19A1 P11511 2/20 0.43
KCNA3 P22001 1/20 0.42
VEGFA P15692 2/20 0.41
EGLN1 Q9GZT9 2/20 0.41
THRB P10828 1/20 0.40
APP P05067 1/20 0.39
HTR6 P50406 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PTGDR Q13258 1/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL1696643 0.88 APP (0.50) BACE1PTGER4PTGER2TP53APP
SCHEMBL6085911 0.81 ADRA2A (0.50) MAPTPOLBTP53KMT2ACYP19A1
SCHEMBL15676807 0.79 BACE1 (0.48) BACE1PTGER4PTGER2CYP19A1
SCHEMBL6190025 0.78 KCNA3 (0.52) MAPTPOLBTP53KMT2ACYP19A1
SCHEMBL6086348 0.78 KCNA3 (0.43) PTGER4PTGER2MAPTPOLBTP53
SCHEMBL987890 0.77 PTGER4 (0.51) PTGER4PTGER2MAPTPOLBVEGFA
SCHEMBL28990232 0.76 BACE1 (0.46) BACE1
SCHEMBL6087453 0.75 RECQL (0.49) MAPTPOLBTP53KMT2AVEGFA
SCHEMBL1271452 0.75 PTGER4 (0.48) PTGER4PTGER2MAPTPOLBTP53
SCHEMBL5446561 0.74 BACE1 (0.45) BACE1PTGER4PTGER2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6987122-B2 2-(1H-indol-3-yl)-2-oxo-acetic acid amides with antitumor activity NOVUSPHARMA S.P.A. (IT) 2006-01-17 US disclosed
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-20040029858-A1 2-(1h-indol-3-yl)-2-oxo-acetic acid amides with antitumor activity NOVUSPHARMA S.P.A. (IT) 2004-02-12 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-1322646-A1 2-(1H-INDOL-3-YL)-2-OXO-ACETIC ACID AMIDES WITH ANTITUMOR ACTIVITY Novuspharma S.p.A. (IT) 2003-07-02 EP 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-2002008225-A1 2-(1H-INDOL-3-YL)-2-OXO-ACETIC ACID AMIDES WITH ANTITUMOR ACTIVITY NOVUSPHARMA S.P.A. (IT) 2002-01-31 WO 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 (2 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 BACE1 4505/4885PTGER4 964/4885PTGER2 513/4885
US-20040029858-A1 2-(1h-indol-3-yl)-2-oxo-acetic acid amides with antitumor activity IDO1, AADAC, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 BACE1 4318/4885PTGER4 3855/4885PTGER2 1705/4885

“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.