SCHEMBL20744301

SCHEMBL20744301

C[C@H]1CN(c2nnc(Cc3ccccc3)c3ccc(C#N)cc23)CCN1c1ccc(C#N)cc1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SGPL1 O95470 12/20 0.78
SMO Q99835 8/20 0.69

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
SCHEMBL20740314 1.00 SGPL1 (0.78) SGPL1SMO
SCHEMBL20740313 1.00 SGPL1 (0.78) SGPL1SMO
SCHEMBL20740316 0.93 SGPL1 (0.79) SGPL1SMO
SCHEMBL20740315 0.93 SGPL1 (0.79) SGPL1SMO
SCHEMBL3607777 0.82 SGPL1 (0.61) SGPL1SMO
SCHEMBL20740311 0.82 SGPL1 (0.61) SGPL1SMO
SCHEMBL3596417 0.81 SGPL1 (1.00) SGPL1SMO
SCHEMBL3596414 0.81 SGPL1 (1.00) SGPL1SMO
SCHEMBL3607834 0.81 SGPL1 (1.00) SGPL1SMO
SCHEMBL13444970 0.79 SMO (1.00) SGPL1SMO

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
EP-3668506-A1 ENHANCEMENT OF CANCER TREATMENT EFFICIENCY VIA THE SPHINGOSINE-1-PHOSPHATE PATHWAY AC BioScience (CH) 2020-06-24 EP claimed
WO-2019034768-A1 ENHANCEMENT OF CANCER TREATMENT EFFICIENCY VIA THE SPHINGOSINE-1-PHOSPHATE PATHWAY AC BIOSCIENCE (CH) 2019-02-21 WO claimed
EP-3668506-A1 ENHANCEMENT OF CANCER TREATMENT EFFICIENCY VIA THE SPHINGOSINE-1-PHOSPHATE PATHWAY AC BioScience (CH) 2020-06-24 EP disclosed
WO-2019034768-A1 ENHANCEMENT OF CANCER TREATMENT EFFICIENCY VIA THE SPHINGOSINE-1-PHOSPHATE PATHWAY AC BIOSCIENCE (CH) 2019-02-21 WO disclosed