SCHEMBL7811355

SCHEMBL7811355

COc1ccc2c(c1)-c1c(c(Cl)nc3ccccc13)C2=O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 3/20 0.50
ACHE P22303 4/20 0.46
GUSB P08236 1/20 0.46
PDE4B Q07343 2/20 0.46
PDE4D Q08499 2/20 0.46
TP53 P04637 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
ELANE P08246 1/20 0.43
LMNA P02545 1/20 0.43
RECQL P46063 1/20 0.43
RXRA P19793 1/20 0.42
GRM2 Q14416 1/20 0.42
ACACA Q13085 1/20 0.42
PTPN1 P18031 1/20 0.42

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
SCHEMBL7822017 0.95 NTRK1 (0.51) NTRK1ACHEGUSBPDE4BPDE4D
SCHEMBL3736581 0.90 NTRK1 (0.51) NTRK1ACHEGUSBPDE4BPDE4D
SCHEMBL7820175 0.86 TP53 (0.51) ACHEPDE4BPDE4DTP53KDM4E
SCHEMBL7825423 0.86 TP53 (0.51) PDE4BPDE4DTP53KDM4EMEN1
SCHEMBL7820788 0.84 USP8 (0.42) NTRK1ACHETP53KDM4EKMT2A
SCHEMBL7464351 0.81 ACHE (0.51) NTRK1ACHEGUSBPDE4BPDE4D
SCHEMBL12781496 0.80 PABPC1 (0.47) NTRK1GUSBMEN1KMT2ALMNA
SCHEMBL7818521 0.80 GUSB (0.45) GUSBKDM4E
SCHEMBL3738396 0.79 ALOX15 (0.43) GUSBKDM4EMEN1POLBKMT2A
SCHEMBL7464693 0.79 ACHE (0.51) NTRK1ACHEGUSBPDE4BPDE4D

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-0713870-B1 NOVEL FUSED INDAN DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2001-07-18 EP disclosed
US-6028079-A FOR TREATING TUMOR OF MAMMAL TAIHO PHARMACEUTICAL CO., LTD (JP) 2000-02-22 US disclosed
US-5733918-A ANTITUMOR AGENT TAIHO PHARMACEUTICAL CO., LTD. (JP) 1998-03-31 US disclosed
US-5710162-A ANTITUMOR AGENTS TAIHO PHARMACEUTICAL CO., LTD. (JP) 1998-01-20 US disclosed
EP-0713870-A1 NOVEL FUSED INDAN DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 1996-05-29 EP disclosed