SCHEMBL9467941

SCHEMBL9467941

CCCCCCCCC#CCC#CCC#CCBr

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
PTPN7 P35236 5/20 0.52
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
USP2 O75604 1/20 0.52
ALDH1A1 P00352 1/20 0.52
POLB P06746 1/20 0.52
MAPT P10636 1/20 0.52
HPGD P15428 1/20 0.52
ALOX12 P18054 1/20 0.52
BLM P54132 1/20 0.52
KMT2A Q03164 1/20 0.52
MCL1 Q07820 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HMGCR P04035 3/20 0.45
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
EPHX2 P34913 4/20 0.36
KCNH2 Q12809 1/20 0.35

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
SCHEMBL9421472 1.00 RECQL (0.55) RECQLTDP1PTPN7KDM4EMEN1
SCHEMBL11526514 1.00 RECQL (0.55) RECQLTDP1PTPN7KDM4EMEN1
SCHEMBL7134875 0.98 PTPN7 (0.53) RECQLTDP1PTPN7KDM4EMEN1
SCHEMBL8775381 0.98 PTPN7 (0.53) RECQLTDP1PTPN7KDM4EMEN1
SCHEMBL9467624 0.98 PTPN7 (0.53) RECQLTDP1PTPN7KDM4EMEN1
SCHEMBL9803976 0.93 PTPN7 (0.50) RECQLTDP1PTPN7KDM4EMEN1
SCHEMBL7135975 0.93 PTPN7 (0.50) RECQLTDP1PTPN7KDM4EMEN1
SCHEMBL22689617 0.93 PTPN7 (0.50) RECQLTDP1PTPN7KDM4EMEN1
SCHEMBL8498681 0.93 PTPN7 (0.50) RECQLTDP1PTPN7KDM4EMEN1
SCHEMBL9496390 0.93 PTPN7 (0.50) RECQLTDP1PTPN7KDM4EMEN1

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-5268494-A Compound containing conjugated triple bonds CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES C.I.R.D. (FR) 1993-12-07 US disclosed
US-5151534-A Antiallergens, antiinflammatory agents or skin disorders CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (CIRD) (FR) 1992-09-29 US disclosed