SCHEMBL12880514

SCHEMBL12880514

CC(C)NC(=O)Cc1cccc(Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.58
ALDH1A1 P00352 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
KCNQ2 O43526 6/20 0.53
HPGD P15428 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
FFAR2 O15552 1/20 0.51
CTBP2 P56545 1/20 0.50
MAPK8 P45983 1/20 0.49
PNMT P11086 1/20 0.49
CSNK1D P48730 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
CNR2 P34972 1/20 0.48

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
SCHEMBL4414835 0.86 ALDH1A1 (0.52) EPHX2ALDH1A1MEN1KMT2AKCNQ2
SCHEMBL4414837 0.86 ALDH1A1 (0.52) EPHX2ALDH1A1MEN1KMT2AKCNQ2
SCHEMBL27531840 0.85 MEN1 (0.50) EPHX2ALDH1A1MEN1KMT2AKCNQ2
SCHEMBL24710028 0.83 MAPK1 (0.63) ALDH1A1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL29179535 0.83 MAPK1 (0.63) ALDH1A1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL30852958 0.83 MAPK1 (0.63) ALDH1A1MEN1KMT2AHPGDSMN1; SMN2
SCHEMBL15065815 0.82 NLRP3 (0.50) ALDH1A1HPGDCTBP2SIGMAR1CNR2
SCHEMBL6709399 0.82 MEN1 (0.51) EPHX2ALDH1A1MEN1KMT2AKCNQ2
SCHEMBL5322005 0.82 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AKCNQ2HPGD
SCHEMBL6386462 0.81 MEN1 (0.59) EPHX2ALDH1A1MEN1KMT2AKCNQ2

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-20110028509-A1 Sulfonamides MERCK SERONO SA (CH) 2011-02-03 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-20110028509-A1 Sulfonamides CXCR3, CXCR2, CXCR1 EPHX2 791/4885ALDH1A1 716/4885MEN1 4478/4885

“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.