SCHEMBL12992249

SCHEMBL12992249

CCCN1C(=O)CCc2ccc(C(=O)OCC)cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
SRD5A1 P18405 1/20 0.48
SRD5A2 P31213 1/20 0.48
DRD3 P35462 1/20 0.45
TRPV1 Q8NER1 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
PABPC1 P11940 2/20 0.43
APOBEC3A P31941 2/20 0.43
EIF4H Q15056 2/20 0.43
APOBEC3G Q9HC16 2/20 0.43
ALDH1A1 P00352 5/20 0.41
ALOX5 P09917 1/20 0.41
MAPT P10636 1/20 0.41
RECQL P46063 1/20 0.41

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
SCHEMBL12991922 0.86 SRD5A1 (0.51) MEN1KMT2ASRD5A1SRD5A2DRD3
SCHEMBL12992068 0.84 TRPV1 (0.48) DRD3TRPV1CA12CA1CA9
SCHEMBL11288709 0.81 SRD5A1 (0.47) MEN1KMT2ASRD5A1SRD5A2DRD3
SCHEMBL2532151 0.81 CHRM1 (0.46) SRD5A1SRD5A2DRD3TRPV1ALDH1A1
SCHEMBL11287504 0.78 SRD5A1 (0.47) MEN1KMT2ASRD5A1SRD5A2CA12
SCHEMBL27569997 0.78 MEN1 (0.50) MEN1KMT2ASRD5A1SRD5A2CA12
SCHEMBL20119292 0.75 RARA (0.51) MEN1KMT2ASRD5A1SRD5A2DRD3
SCHEMBL12991995 0.74 ATAD2 (0.60) DRD3TRPV1POLB
SCHEMBL17979481 0.74 HDAC1 (0.51) DRD3TRPV1MAPTPOLBNPC1
SCHEMBL11277835 0.73 SRD5A1 (0.58) MEN1KMT2ASRD5A1SRD5A2CA12

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7855198-B2 Benzamide derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2010-12-21 US disclosed
US-20090270365-A1 such as N-(2,4-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-(piperidin-1-ylmethyl)biphenyl-4-carboxamide, having vanilloid receptor 1 antagonistic activity, used as analgesics ASTELLAS PHARMA INC. (JP) 2009-10-29 US disclosed
US-7585878-B2 Benzamide derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2009-09-08 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-20090270365-A1 such as N-(2,4-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-(piperidin-1-ylmethyl)biphenyl-4-carboxamide, having vanilloid receptor 1 antagonistic activity, used as analgesics TRPV1, TRPV2, TRPV3 MEN1 2040/4885KMT2A 1040/4885SRD5A1 2012/4885

“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.