Cyclohexane

Cyclohexane

SCHEMBL8419079

C1CCCCC1.N.N.O=C(O)c1ccccc1-c1ccccc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.60
BCAT2 O15382 1/20 0.59
TSHR P16473 1/20 0.58
RECQL P46063 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
ALDH1A1 P00352 2/20 0.56
LMNA P02545 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
FABP3 P05413 1/20 0.55
FABP4 P15090 1/20 0.55
FABP5 Q01469 1/20 0.55
GAA P10253 1/20 0.53
ALOX15 P16050 1/20 0.52
CHRNB2 P17787 2/20 0.52
CHRNB4 P30926 2/20 0.52
CHRNA3 P32297 2/20 0.52
CHRNA4 P43681 2/20 0.52
NPC1 O15118 1/20 0.51

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
Ammonia Solution, Strong SCHEMBL27350797 0.94 HNF4A (0.67) HNF4ABCAT2TSHRRECQLSMN1; SMN2
Benzene SCHEMBL1403559 0.91 HNF4A (0.69) HNF4ABCAT2TSHRRECQLSMN1; SMN2
SCHEMBL133057 0.91 HNF4A (0.69) HNF4ABCAT2TSHRRECQLSMN1; SMN2
SCHEMBL26624744 0.91 HNF4A (0.69) HNF4ABCAT2TSHRRECQLSMN1; SMN2
Benzene SCHEMBL28480917 0.91 HNF4A (0.69) HNF4ABCAT2TSHRRECQLSMN1; SMN2
SCHEMBL8615784 0.89 HNF4A (0.67) HNF4ABCAT2TSHRRECQLSMN1; SMN2
Fluoride SCHEMBL11030268 0.89 HNF4A (0.67) HNF4ABCAT2TSHRRECQLSMN1; SMN2
Biphenyl SCHEMBL9292498 0.89 HNF4A (0.67) HNF4ABCAT2TSHRRECQLSMN1; SMN2
SCHEMBL7407371 0.89 HNF4A (0.73) HNF4ABCAT2TSHRRECQLSMN1; SMN2
SCHEMBL8872993 0.89 HNF4A (0.67) HNF4ABCAT2TSHRRECQLSMN1; SMN2

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
JP-11171989-A None JP disclosed
JP-H11171989-A POLYAMIDE RESIN AND POLYAMIDE RESIN COMPOSITION FOR CONNECTOR TORAY IND INC 1999-06-29 JP disclosed