SCHEMBL9533109

SCHEMBL9533109

CCC1(N)CNCCN1CCO

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.31
SOS2 Q07890 1/20 0.31

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
SCHEMBL7026605 0.82 TSHR (0.33) SOS1SOS2
SCHEMBL6700151 0.81 GNAO1 (0.34) SOS1SOS2
SCHEMBL8142778 0.79 SOS1 (0.32) SOS1SOS2
SCHEMBL9801060 0.74 SOS1 (0.34) SOS1SOS2
SCHEMBL7026672 0.74 SOS1 (0.32) SOS1SOS2
Hydrochloric Acid SCHEMBL20660386 0.73 SOS1 (0.33) SOS1SOS2
SCHEMBL7025044 0.71 MEN1 (0.31) SOS1SOS2
SCHEMBL24745284 0.71 SOS1 (0.42) SOS1SOS2
Ethylenediamine SCHEMBL9064148 0.69
SCHEMBL19717818 0.69

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-0525123-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES. UPJOHN CO (US) 1993-02-03 EP disclosed
US-4804758-A FROM HETEROCYCLIC AMINES USING BORON OR IRON SILICATE ZEOLITE CATALYSTS BASF AKTIENGESELLSCHAFT (DE) 1989-02-14 US disclosed