SCHEMBL13994417

SCHEMBL13994417

COc1ccc(F)cc1BC(C)C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.37
▸ HTR2A P28223 4/20 0.37
▸ HTR2C P28335 4/20 0.37
▸ HTR2B P41595 3/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ PDGFRB P09619 1/20 0.34
▸ PDGFRA P16234 1/20 0.34

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
SCHEMBL14500180 0.79 KDM4E (0.44) NFE2L2KDM4EHTR2AHTR2CHTR2B
SCHEMBL8228846 0.77 NFE2L2 (0.42) NFE2L2KDM4EHTR2AHTR2CHTR2B
SCHEMBL8119851 0.71 NFE2L2 (0.43) NFE2L2KDM4EHTR2AHTR2CPTGS1
SCHEMBL166380 0.71 NFE2L2 (0.61) NFE2L2KDM4EPTGS1TSHRPDGFRB
SCHEMBL18472613 0.71 NFE2L2 (0.61) NFE2L2KDM4EPTGS1TSHRPDGFRB
SCHEMBL24306428 0.69 NFE2L2 (0.46) NFE2L2KDM4EPTGS1SLC6A2SLC6A4
SCHEMBL28299621 0.69 NFE2L2 (0.59) NFE2L2KDM4EPTGS1TSHRPDGFRB
SCHEMBL8940603 0.69 ERN1 (0.51) NFE2L2KDM4EPTGS1SMN1; SMN2USP2
SCHEMBL197204 0.69 LMNA (0.53) NFE2L2KDM4EPTGS1HTTPDGFRB
SCHEMBL29366053 0.69 LMNA (0.53) NFE2L2KDM4EPTGS1HTTPDGFRB

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
US-7470015-B2 Inkjet-recording ink composition and image-forming process FUJIFILM CORPORATION (JP) 2008-12-30 — — US disclosed
US-7229737-B2 Photopolymerizable composition and recording material and recording process using the same FUJIFILM CORPORATION (JP) 2007-06-12 — — US disclosed
Send feedback