SCHEMBL8906830

SCHEMBL8906830

O=C(Cc1c(F)cccc1Cl)NC1(C(=O)O)CCC(c2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
KMT2A Q03164 5/20 0.46
GAA P10253 1/20 0.46
P2RX7 Q99572 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
NPSR1 Q6W5P4 2/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 3/20 0.42
POLB P06746 1/20 0.42
MEN1 O00255 1/20 0.42
RECQL P46063 1/20 0.42
TSHR P16473 1/20 0.42
NPC1 O15118 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
SCHEMBL8907213 0.92 KMT2A (0.50) ALDH1A1KMT2AMAPTMEN1RECQL
SCHEMBL8907198 0.90 SMN1; SMN2 (0.48) ALDH1A1KMT2AGAAP2RX7SMN1; SMN2
SCHEMBL8907390 0.89 ALDH1A1 (0.53) ALDH1A1KMT2AGAAP2RX7SMN1; SMN2
SCHEMBL8906391 0.85 ALDH1A1 (0.51) ALDH1A1KMT2AGAAP2RX7SMN1; SMN2
SCHEMBL8905521 0.84 ALDH1A1 (0.50) ALDH1A1KMT2AGAAP2RX7SMN1; SMN2
SCHEMBL8907162 0.84 ALDH1A1 (0.50) ALDH1A1KMT2AGAAP2RX7SMN1; SMN2
SCHEMBL8906367 0.82 ALDH1A1 (0.50) ALDH1A1KMT2AGAAP2RX7SMN1; SMN2
SCHEMBL8907366 0.81 KMT2A (0.46) ALDH1A1KMT2ASMN1; SMN2MAPT
SCHEMBL8905949 0.80 KMT2A (0.52) ALDH1A1KMT2AGAAP2RX7SMN1; SMN2
SCHEMBL6771746 0.80 ALDH1A1 (0.61) ALDH1A1KMT2ASMN1; SMN2NPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1065524-C Substituted phenyl acetanides, process for their preparation and intermediates thereof BAYER AG (DE) 2001-05-09 CN disclosed
CN-1044366-C Aryl pyrrolidine diketone derivative and preparation method thereof, and pesticide and herbicide containing aryl pyrrolidine diketone derivative and pesticide and herbicide application thereof BAYER AG (DE) 1999-07-28 CN disclosed
CN-1190650-A Substituted phenyl acetanides, process for their preparation and intermediates thereof BAYER AG (DE) 1998-08-19 CN disclosed
US-5677449-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-10-14 US disclosed
US-5462913-A Pesticides, insecticides, miticides, herbicides BAYER AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
CN-1086213-A Substituted 1-H-3-aryl-pyrrolidine-2, 4-dione derivatives BAYER AG (DE) 1994-05-04 CN disclosed