SCHEMBL7987480

SCHEMBL7987480

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
LMNA P02545 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PABPC1 P11940 1/20 0.41
ATM Q13315 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
GAA P10253 3/20 0.39
KDM4E B2RXH2 3/20 0.39
TSHR P16473 1/20 0.38
ALDH1A1 P00352 2/20 0.37
POLB P06746 2/20 0.37
HTT P42858 1/20 0.37
RXFP1 Q9HBX9 3/20 0.37
ADORA1 P30542 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
SCHEMBL7992501 0.84 TSHR (0.41) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL7975426 0.83 GAA (0.41) MAPTLMNASMN1; SMN2KMT2APABPC1
SCHEMBL7992154 0.78 MAPT (0.38) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL20998225 0.76 ADORA1 (0.55) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL8138202 0.75 CHRM2 (0.32) HRH2HRH1
SCHEMBL18092279 0.75 MAPT (0.42) MAPTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL17611778 0.74 ADORA1 (0.47) MAPTSMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL12764026 0.73 MEN1 (0.40) MAPTSMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL4399188 0.71 TMEM97 (0.49) SMN1; SMN2MEN1KMT2AHRH2HRH1
SCHEMBL568818 0.71 TSHR (0.47) MAPTLMNASMN1; SMN2MEN1KMT2A

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