Cyclohexane

Cyclohexane

SCHEMBL4198294

C1CCCCC1.COc1cccc(-c2ccc(S(=O)(=O)Nc3ccccc3CNC(C)C)s2)c1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
LMNA P02545 3/20 0.43
TP53 P04637 3/20 0.43
MAPT P10636 2/20 0.43
NLRP3 Q96P20 1/20 0.43
GHSR Q92847 4/20 0.42
MEN1 O00255 1/20 0.41
PKM P14618 1/20 0.41
KMT2A Q03164 1/20 0.41
PTGES2 Q9H7Z7 1/20 0.40
MMP2 P08253 2/20 0.40
POLB P06746 2/20 0.40
MMP1 P03956 1/20 0.40
MMP3 P08254 1/20 0.40
MMP13 P45452 1/20 0.40
MAPK1 P28482 1/20 0.40
MMP9 P14780 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL4195119 0.89 GHSR (0.38) NPC1RAB9ALMNATP53MAPT
SCHEMBL4198289 0.89 GHSR (0.38) NPC1RAB9ALMNATP53MAPT
Cyclopentane SCHEMBL4197408 0.87 GHSR (0.49) NPC1RAB9ALMNATP53MAPT
Cyclohexane SCHEMBL4188186 0.84 MMP13 (0.44) NPC1RAB9ALMNATP53MAPT
SCHEMBL4195566 0.79 MMP13 (0.43) NLRP3GHSRMMP2MMP1MMP3
SCHEMBL4185970 0.77 KDM4E (0.40) LMNATP53MAPTGHSRMEN1
SCHEMBL4189890 0.77 MMP13 (0.40) NPC1RAB9ALMNATP53MAPT
SCHEMBL4195287 0.77 MMP13 (0.40) NPC1RAB9ALMNATP53MAPT
SCHEMBL4203709 0.76 GHSR (0.43) TP53MAPTGHSRPKMPTGES2
SCHEMBL4197519 0.76 GHSR (0.43) TP53MAPTGHSRPKMPTGES2

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 NPC1 1859/4885RAB9A 4342/4885LMNA 2332/4885

“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.