SCHEMBL6989926

SCHEMBL6989926

Clc1ccc(Cc2cc3cc(Br)ccc3[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.49
IDO1 P14902 5/20 0.45
GPR183 P32249 1/20 0.44
SIRT1 Q96EB6 1/20 0.43
EGFR P00533 1/20 0.43
FLT1 P17948 1/20 0.43
KDR P35968 1/20 0.43
F2 P00734 1/20 0.43
PCSK9 Q8NBP7 1/20 0.41
CYP19A1 P11511 1/20 0.41
RHEB Q15382 1/20 0.40
FFAR1 O14842 1/20 0.40
DAO P14920 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CNR1 P21554 1/20 0.37

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
SCHEMBL8802664 0.91 LOXL2 (0.57) LOXL2IDO1SIRT1EGFRFLT1
SCHEMBL6826452 0.87 LOXL2 (0.64) LOXL2SIRT1EGFRF2PCSK9
SCHEMBL28178529 0.84 F2 (0.58) IDO1EGFRF2CYP19A1SMN1; SMN2
SCHEMBL865591 0.83 CYP19A1 (0.50) LOXL2IDO1F2CYP19A1FFAR1
SCHEMBL9530334 0.81 MEN1 (0.49) LOXL2SIRT1EGFRKDRF2
SCHEMBL6994727 0.81 LOXL2 (0.57) LOXL2SIRT1F2PCSK9RHEB
SCHEMBL6984195 0.81 LOXL2 (0.49) LOXL2SIRT1F2PCSK9RHEB
SCHEMBL15363374 0.80 PDE3B (0.45) GPR183DAO
SCHEMBL6619148 0.79 PCSK9 (0.57) LOXL2F2PCSK9DAO
SCHEMBL6989299 0.78 LOXL2 (0.57) LOXL2IDO1SIRT1F2PCSK9

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