Sugi Predict

Sugi Predict / Compounds / SCHEMBL9207980

SCHEMBL9207980

SCHEMBL9207980

CCCCCCCCCCCCCCCCC1(NCC)CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 4/20 0.38
▸ CNR1 P21554 2/20 0.32
▸ CNR2 P34972 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ SIRT2 Q8IXJ6 1/20 0.32

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
SCHEMBL9210658 1.00 CETP (0.38) CETPCNR1CNR2TSHRTHRB
SCHEMBL9206447 0.94 TSHR (0.33) CETPTSHRTHRBSIRT2
SCHEMBL9206540 0.94 TSHR (0.33) CETPTSHRTHRBSIRT2
SCHEMBL9205259 0.94 TSHR (0.33) CETPTSHRTHRBSIRT2
SCHEMBL18594767 0.92 CETP (0.36) CETP
SCHEMBL11260424 0.86 CETP (0.37) CETPCNR1CNR2TSHRTHRB
SCHEMBL9208824 0.86 EPHX1 (0.37) CETPTSHR
SCHEMBL28204470 0.82 EPHX1 (0.37) CETPTSHR
SCHEMBL11355328 0.81 LMNA (0.32) TSHR
SCHEMBL9213009 0.80 EPHX1 (0.33) CETPTSHRTHRBSIRT2

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
EP-0421441-B1 Pantothenic acid derivatives FUJIREBIO KK (JP) 1995-01-25 — — EP disclosed
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 — — US disclosed
EP-0421441-A2 Pantothenic acid derivatives FUJIREBIO INC. (JP) 1991-04-10 — — EP disclosed