SCHEMBL11360985

SCHEMBL11360985

CCOC1CCCCCN1OCC

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL9368807 0.98 ALDH1A1 (0.32) ALDH1A1THRBATML3MBTL1
SCHEMBL5559448 0.76 TSHR (0.30) L3MBTL1
SCHEMBL28870943 0.74 MEN1 (0.35) ALDH1A1
SCHEMBL14215996 0.74 CYP1A2 (0.38) ALDH1A1THRBATML3MBTL1
SCHEMBL28265108 0.73
SCHEMBL4635197 0.72 ALDH1A1 (0.33) ALDH1A1THRBATML3MBTL1
Hydrochloric Acid SCHEMBL28297019 0.72 CYP1A2 (0.37) ALDH1A1THRBATML3MBTL1
SCHEMBL28284568 0.72 KMT2A (0.38) ALDH1A1
SCHEMBL28801681 0.72 ALDH1A1 (0.33) ALDH1A1THRBATML3MBTL1
SCHEMBL11478949 0.70 ALDH1A1 (0.36) ALDH1A1THRBATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4282201-A Pharmaceutical comprising drug and polymer ALZA CORPORATION (US) 1981-08-04 US disclosed
US-4259102-A Composition comprising useful agent such as fertilizers, housed in heterocyclic polymer ALZA CORPORATION (US) 1981-03-31 US disclosed
US-4246397-A Polymers comprising heterocyclic system ALZA CORPORATION (US) 1981-01-20 US disclosed