SCHEMBL12264129

SCHEMBL12264129

c1ccc(C(NCCN(CCNC(c2ccccc2)(c2ccccc2)c2ccccc2)CCNC(c2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.61
KCNN4 O15554 3/20 0.54
DUT P33316 3/20 0.40
MIF P14174 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
SIGMAR1 Q99720 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
SCHEMBL22919848 0.94 KIF11 (0.55) KIF11KCNN4DUTSIGMAR1
SCHEMBL9926038 0.91 KIF11 (0.67) KIF11KCNN4DUT
SCHEMBL28742617 0.88 KCNN4 (0.57) KIF11KCNN4SIGMAR1
SCHEMBL12264131 0.84 KIF11 (0.74) KIF11KCNN4DUTMIF
SCHEMBL9654002 0.81 KIF11 (0.46) KIF11KCNN4DUTSMN1; SMN2
SCHEMBL1809571 0.80 KIF11 (0.63) KIF11KCNN4DUTMIF
SCHEMBL12264133 0.79 KIF11 (0.68) KIF11KCNN4DUTSIGMAR1
SCHEMBL29679194 0.77 KIF11 (0.65) KIF11KCNN4DUTSIGMAR1
SCHEMBL147990 0.77 KIF11 (0.65) KIF11KCNN4DUTSMN1; SMN2
SCHEMBL3111880 0.77 KIF11 (0.59) KIF11KCNN4DUTMIFSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8026263-B2 Methods for inhibiting neoproliferative changes in blood vessel walls THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-09-27 US disclosed
US-8026263-B2 Methods for inhibiting neoproliferative changes in blood vessel walls THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-09-27 US disclosed
US-7235577-B1 Non-peptide inhibition of T-lymphocyte activation and therapies related thereto THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-06-26 US disclosed
US-7235577-B1 Non-peptide inhibition of T-lymphocyte activation and therapies related thereto THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-06-26 US disclosed