SCHEMBL7992501

SCHEMBL7992501

CCCC(=O)C1=C(Cl)CCN(C(=O)OCC)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
MAPT P10636 6/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
LMNA P02545 3/20 0.40
KMT2A Q03164 2/20 0.40
MAPK1 P28482 2/20 0.40
MEN1 O00255 1/20 0.40
PABPC1 P11940 1/20 0.40
ATM Q13315 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HTT P42858 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 1/20 0.40
POLB P06746 2/20 0.40
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
CYP3A4 P08684 1/20 0.36

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
SCHEMBL7987480 0.84 MAPT (0.41) TSHRMAPTSMN1; SMN2LMNAKMT2A
SCHEMBL7985767 0.84 SMN1; SMN2 (0.42) TSHRMAPTSMN1; SMN2LMNAKMT2A
SCHEMBL7988450 0.79 ALDH1A1 (0.40) TSHRMAPTSMN1; SMN2LMNAKMT2A
SCHEMBL978091 0.75 ALDH1A1 (0.42) TSHRMAPTSMN1; SMN2LMNAKMT2A
SCHEMBL11171177 0.70 ALDH1A1 (0.47) TSHRMAPTSMN1; SMN2LMNAKMT2A
SCHEMBL7975426 0.70 GAA (0.41) TSHRMAPTSMN1; SMN2LMNAKMT2A
SCHEMBL568818 0.70 TSHR (0.47) TSHRMAPTSMN1; SMN2LMNAKMT2A
SCHEMBL18092279 0.68 MAPT (0.42) TSHRMAPTSMN1; SMN2LMNAKMT2A
SCHEMBL1713222 0.67 TSHR (0.57) TSHRMAPTSMN1; SMN2LMNAKMT2A
SCHEMBL4752592 0.67 SMN1; SMN2 (0.47) TSHRSMN1; SMN2LMNAKMT2AMEN1

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