SCHEMBL7989492

SCHEMBL7989492

CCOC(=O)Cn1ncc2c1CC1CCC2N1C(=O)C(OC)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
RAB9A P51151 2/20 0.37
RET P07949 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
ADORA1 P30542 1/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 1/20 0.34
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL7986449 0.81 SMN1; SMN2 (0.40) SMN1; SMN2MEN1KMT2ATSHRHTT
SCHEMBL7989252 0.80 RAB9A (0.35) RAB9ARETMEN1KMT2ATSHR
SCHEMBL7989746 0.77 SMN1; SMN2 (0.39) SMN1; SMN2MEN1KMT2AGAAALDH1A1
SCHEMBL7988257 0.76 RAB9A (0.35) SMN1; SMN2RAB9ARETTSHRKDM4E
SCHEMBL8137379 0.71 KCNH2 (0.41) RAB9ARETKDM4EALDH1A1
SCHEMBL7989148 0.67 CHRM2 (0.39)
Hydrochloric Acid SCHEMBL7989639 0.65 SMN1; SMN2 (0.39) SMN1; SMN2MEN1KMT2ATSHRHTT
SCHEMBL28268129 0.64 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2ATSHRHTT
SCHEMBL750631 0.64 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2ATSHRHTT
SCHEMBL13513393 0.63 SMN1; SMN2 (0.42) SMN1; SMN2MEN1KMT2ATSHRHTT

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