SCHEMBL10592014

SCHEMBL10592014

C=CC(CCCC)OCCCC

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.36
HPGD P15428 1/20 0.36
DNM1 Q05193 3/20 0.32
ALDH1A1 P00352 2/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
ATM Q13315 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 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
SCHEMBL1142866 0.92 DNM1 (0.38) TSHRHPGDDNM1
SCHEMBL1142556 0.92 DNM1 (0.38) TSHRHPGDDNM1
SCHEMBL1142189 0.92 DNM1 (0.38) TSHRHPGDDNM1
SCHEMBL1142446 0.92 DNM1 (0.38) TSHRHPGDDNM1
SCHEMBL12942884 0.88 TSHR (0.46) TSHRHPGDALDH1A1ATMCNR1
SCHEMBL8945762 0.88 DNM1 (0.42) TSHRDNM1ALDH1A1CNR1CNR2
SCHEMBL28042753 0.88 DNM1 (0.42) TSHRDNM1ALDH1A1CNR1CNR2
SCHEMBL23403877 0.86 TSHR (0.39) TSHRHPGDALDH1A1SMN1; SMN2CNR1
SCHEMBL1142770 0.83 TSHR (0.37) TSHRDNM1
SCHEMBL1142355 0.83 TSHR (0.37) TSHRDNM1

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
EP-0324059-A2 Positive working radiation-sensitive composition and radiation-sensitive recording material produced therefrom HOECHST AKTIENGESELLSCHAFT (DE) 1989-07-19 EP disclosed