SCHEMBL7992154

SCHEMBL7992154

CCOC(=O)N1CCC(O)=C(C(=O)C(F)(F)F)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
GAA P10253 3/20 0.38
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
LMNA P02545 3/20 0.38
PABPC1 P11940 1/20 0.38
ATM Q13315 1/20 0.38
TSHR P16473 1/20 0.37
ALDH1A1 P00352 4/20 0.36
HPGD P15428 2/20 0.36
POLB P06746 2/20 0.36
HTT P42858 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RXFP1 Q9HBX9 2/20 0.36
ADORA1 P30542 1/20 0.36
HDAC4 P56524 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
ABL1 P00519 1/20 0.35
RIN1 Q13671 1/20 0.35

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
SCHEMBL7988450 0.84 ALDH1A1 (0.40) MAPTGAAKDM4ESMN1; SMN2LMNA
SCHEMBL7975426 0.82 GAA (0.41) MAPTGAAKDM4ESMN1; SMN2LMNA
SCHEMBL12837008 0.80 ESR1 (0.42) MAPTKDM4ESMN1; SMN2TSHRALDH1A1
SCHEMBL7987480 0.78 MAPT (0.41) MAPTGAAKDM4ESMN1; SMN2LMNA
SCHEMBL20998225 0.75 ADORA1 (0.55) MAPTGAASMN1; SMN2LMNAATM
SCHEMBL18092279 0.74 MAPT (0.42) MAPTGAAKDM4ESMN1; SMN2LMNA
SCHEMBL17611778 0.73 ADORA1 (0.47) MAPTGAAKDM4ESMN1; SMN2MEN1
SCHEMBL12764026 0.72 MEN1 (0.40) MAPTKDM4ESMN1; SMN2TSHRALDH1A1
SCHEMBL4399188 0.70 TMEM97 (0.49) SMN1; SMN2MEN1KMT2A
SCHEMBL568818 0.70 TSHR (0.47) MAPTGAAKDM4ESMN1; SMN2LMNA

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
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed