SCHEMBL19255977

SCHEMBL19255977

O=C1CC2(CCCCCCCCC2)CC(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.41
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
CYP2C19 P33261 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL346851 1.00 CRBN (0.41) CRBNKDM4ELMNACYP2C19SMN1; SMN2
SCHEMBL529832 0.97 CRBN (0.43) CRBNKDM4ELMNACYP2C19SMN1; SMN2
SCHEMBL9238801 0.94 CRBN (0.41) CRBNKDM4ELMNACYP2C19SMN1; SMN2
SCHEMBL19585725 0.85 CRBN (0.44) CRBNKDM4ELMNACYP2C19ALDH1A1
SCHEMBL22271225 0.82 CRBN (0.48) CRBNKDM4ELMNACYP2C19
SCHEMBL20633686 0.79 NEK2 (0.36) CRBNKDM4ELMNACYP2C19ALDH1A1
SCHEMBL6229229 0.77 OPRM1 (0.46) CRBNSMN1; SMN2
SCHEMBL483007 0.77 OPRM1 (0.46) CRBNSMN1; SMN2
SCHEMBL428337 0.77 ESR2 (0.38) SMN1; SMN2ALDH1A1
SCHEMBL2527186 0.76 NEK2 (0.41) CRBNKDM4ELMNACYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170233529-A1 BIS(AZOBENZENE) DIAMINES AND PHOTOMECHANICAL POLYMERS MADE THEREFROM GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2017-08-17 US disclosed