Sugi Predict

Sugi Predict / Compounds / SCHEMBL9575307

SCHEMBL9575307

SCHEMBL9575307

CCCCN(CCCC)c1nc(NCCC2CC(C)(C)NC(C)(C)C2)nc(NCCC2CC(C)(C)NC(C)(C)C2)n1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ SLC29A1 Q99808 2/20 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
SCHEMBL9575542 0.95 SLC29A1 (0.33) CRHR1SMN1; SMN2TSHRSLC29A1
SCHEMBL9575437 0.93 SLC29A1 (0.36) CRHR1SMN1; SMN2SLC29A1
SCHEMBL9575285 0.93 SMN1; SMN2 (0.40) CRHR1SMN1; SMN2TSHRSLC29A1
SCHEMBL11622058 0.90 TSHR (0.35) SMN1; SMN2TSHR
SCHEMBL9575343 0.89 SLC29A1 (0.37) CRHR1SMN1; SMN2SLC29A1
SCHEMBL9575357 0.88 CRHR1 (0.36) CRHR1SMN1; SMN2SLC29A1
SCHEMBL9575473 0.87 CA1 (0.36) TSHR
SCHEMBL9497036 0.87 SMN1; SMN2 (0.38) CRHR1SMN1; SMN2TSHRSLC29A1
SCHEMBL294894 0.85 SLC29A1 (0.32) TSHRSLC29A1
SCHEMBL11331854 0.84 SMN1; SMN2 (0.38) CRHR1SMN1; SMN2SLC29A1

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
EP-0227640-B1 POLYOLEFINS STABILISED BY BIS-(POLYALKYLPIPERIDINYL-AMINO)-1,3,5-TRIAZINES CIBA-GEIGY AG (CH) 1993-05-26 — — EP claimed
EP-0227640-B1 POLYOLEFINS STABILISED BY BIS-(POLYALKYLPIPERIDINYL-AMINO)-1,3,5-TRIAZINES CIBA-GEIGY AG (CH) 1993-05-26 — — EP disclosed