SCHEMBL6993438

SCHEMBL6993438

COC(=O)c1ccc2[nH]c(Cc3ccc(Cl)cc3)cc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.52
F2 P00734 1/20 0.47
SIRT1 Q96EB6 1/20 0.45
MAPT P10636 5/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
LMNA P02545 3/20 0.45
DRD2 P14416 1/20 0.44
TBXA2R P21731 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
FFAR1 O14842 1/20 0.42
IDH1 O75874 1/20 0.41
CREBBP Q92793 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RXFP3 Q9NSD7 1/20 0.41

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
SCHEMBL7491861 0.90 MAPT (0.45) SMN1; SMN2SIRT1MAPTMEN1KMT2A
SCHEMBL19360455 0.89 MET (0.48) SMN1; SMN2F2MEN1KMT2ACREBBP
SCHEMBL978722 0.87 F2 (0.62) SMN1; SMN2F2MEN1KMT2ALMNA
SCHEMBL19360375 0.84 KDM4E (0.46) SMN1; SMN2F2LMNANPC1RAB9A
SCHEMBL6987109 0.84 F2 (0.54) SMN1; SMN2F2SIRT1FFAR1ALDH1A1
SCHEMBL19360603 0.83 MRGPRX4 (0.49) F2MAPTMEN1KMT2ALMNA
SCHEMBL7495434 0.81 MTNR1A (0.49) SMN1; SMN2F2MAPTLMNANPC1
SCHEMBL29465605 0.80 SMN1; SMN2 (0.47) SMN1; SMN2F2SIRT1MAPTLMNA
SCHEMBL19360311 0.80 SMN1; SMN2 (0.47) SMN1; SMN2F2SIRT1MAPTLMNA
SCHEMBL5794918 0.80 MEN1 (0.49) SMN1; SMN2MEN1KMT2ALMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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