Cyclohexane

Cyclohexane

SCHEMBL4184322

C1CCCCC1.CC(C)N(Cc1ccccc1NS(=O)(=O)c1ccc2c(c1)CCN(C(=O)C(F)(F)F)C2)OC(=O)C(C)(C)C

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.42
ESR2 Q92731 2/20 0.42
MOGAT2 Q3SYC2 9/20 0.40
ALDH1A1 P00352 2/20 0.39
NPSR1 Q6W5P4 2/20 0.38
GAA P10253 2/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
RECQL P46063 1/20 0.38
PTGES2 Q9H7Z7 2/20 0.37

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
SCHEMBL4184319 0.91 MOGAT2 (0.43) ESR1ESR2MOGAT2LMNATP53
Cyclopentane SCHEMBL4198281 0.83 ESR1 (0.46) ESR1ESR2MOGAT2ALDH1A1NPSR1
Cyclohexane SCHEMBL4193643 0.83 ESR1 (0.46) ESR1ESR2MOGAT2ALDH1A1NPSR1
Cyclohexanol SCHEMBL4191255 0.79 MOGAT2 (0.44) ESR1ESR2MOGAT2LMNATP53
SCHEMBL4186009 0.78 MOGAT2 (0.47) ESR1ESR2MOGAT2LMNATP53
SCHEMBL4191248 0.77 MOGAT2 (0.45) ESR1ESR2MOGAT2LMNATP53
SCHEMBL4191252 0.77 MOGAT2 (0.45) ESR1ESR2MOGAT2LMNATP53
SCHEMBL4184464 0.77 MOGAT2 (0.47) ESR1ESR2MOGAT2LMNATP53
SCHEMBL14343600 0.77 MOGAT2 (0.43) ESR1ESR2MOGAT2LMNATP53
SCHEMBL4200117 0.75 TSHR (0.40) MOGAT2ALDH1A1GAALMNATP53

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-20090215764-A1 Antimicrobial agents RANBAXY LABORATORIES LIMITED (IN) 2009-08-27 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090215764-A1 Antimicrobial agents TUFM, RPS17, HARS1 ESR1 1212/4885ESR2 714/4885MOGAT2 3660/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.