Cyclohexylamine

Cyclohexylamine

SCHEMBL5849650

NC1CCCCC1.OC1Cc2ccccc21

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 8/20 0.42
KDM1B Q8NB78 2/20 0.42
SIGMAR1 Q99720 2/20 0.41
PLAU P00749 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
SCHEMBL12228571 0.82
SCHEMBL16870529 0.82 GRIN2D (0.45) KDM1A
SCHEMBL30968744 0.82
Dimethylamine SCHEMBL28626358 0.75 SIGMAR1 (0.43) KDM1ASIGMAR1
SCHEMBL2192471 0.72 EPHX1 (0.46) SIGMAR1
Cyclooctanamine SCHEMBL6810973 0.71 IDO1 (0.50) SIGMAR1PLAU
SCHEMBL12279944 0.71 RET (0.50) SIGMAR1PLAU
SCHEMBL2192515 0.69 TSHR (0.48) SIGMAR1
SCHEMBL29182252 0.69 TSHR (0.48) SIGMAR1
SCHEMBL29622997 0.69 TSHR (0.48) SIGMAR1

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
US-7112605-B2 Sulfonyl-containing 3,4-diaryl-3-pyrrolin-2-ones, preparation method, and medical use thereof Research Institute of Materia Medica Chinese Acadamy of Medical Sciences (CN) 2006-09-26 US disclosed
US-20040029951-A1 Sulfonyl-containing 3,4-diaryl-3-pyrrolin-2-ones, preparation method, and medical use thereof RESEARCH INSTITUTE OF MATERIAL MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES; 2004-02-12 US disclosed

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-20040029951-A1 Sulfonyl-containing 3,4-diaryl-3-pyrrolin-2-ones, preparation method, and medical use thereof PTGS1, PTGS2, PTGER1 KDM1A 577/4885KDM1B 412/4885SIGMAR1 925/4885

“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.