Cyclohexane

Cyclohexane

SCHEMBL7945022

C1=Cc2ccccc21.C1=Cc2ccccc21.C1CCCCC1.C=CC=C

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
P2RX1 P51575 3/20 0.34
P2RX3 P56373 3/20 0.34
P2RX4 Q99571 3/20 0.34
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
BCHE P06276 1/20 0.31
POLB P06746 1/20 0.31
PTPRC P08575 1/20 0.31
THRB P10828 1/20 0.31
PKM P14618 1/20 0.31
IDO1 P14902 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
PTPN1 P18031 1/20 0.31
ACHE P22303 1/20 0.31

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
Butadiene SCHEMBL7152775 0.91 MAPT (0.41) MAPTGAAALDH1A1TSHRKDM4E
SCHEMBL9014947 0.77 MAPT (0.39) MAPTGAAALDH1A1TSHRKDM4E
Propene SCHEMBL28136016 0.77 MAPT (0.39) MAPTGAAP2RX1P2RX3P2RX4
Ethylene SCHEMBL9551923 0.75 MAPT (0.47) MAPTGAAP2RX1P2RX3P2RX4
SCHEMBL29398195 0.74
SCHEMBL3767165 0.74 MAPT (0.53) MAPTGAAP2RX4ALDH1A1TSHR
SCHEMBL33554 0.74
SCHEMBL29418986 0.74 MAPT (0.53) MAPTGAAP2RX4ALDH1A1TSHR
SCHEMBL29375766 0.74 MAPT (0.53) MAPTGAAP2RX4ALDH1A1TSHR
SCHEMBL27566643 0.74 MAPT (0.53) MAPTGAAP2RX4ALDH1A1TSHR

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-6261974-B1 HEATING DIVINYLSILOXANE BIS(BENZOCYCLOBUTENE) IN VAPORIZATION CONTROLLER TO ADDITION POLYMERIZE NEC CORPORATION (JP) 2001-07-17 US disclosed