SCHEMBL2239408

SCHEMBL2239408

O=C(O)N1CCN(C(=O)O)C(Cc2ccccc2)(c2cccnc2)C1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 5/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 3/20 0.41
CYP3A4 P08684 1/20 0.41
EPHX1 P07099 1/20 0.41
EPHX2 P34913 1/20 0.41
CHRM1 P11229 1/20 0.40
CHRM2 P08172 1/20 0.39
PKLR P30613 1/20 0.39
ALOX15 P16050 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.38
HSD11B1 P28845 1/20 0.38
PKM P14618 1/20 0.38
TDP1 Q9NUW8 1/20 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
SCHEMBL5619307 0.71 OPRM1 (0.40) ALDH1A1CHRM1HSD11B1
SCHEMBL3442360 0.70 ALDH1A1 (0.67) MEN1KMT2AALDH1A1LMNACYP3A4
SCHEMBL2811768 0.69 MEN1 (0.44) MEN1KMT2AALDH1A1LMNACYP3A4
SCHEMBL23089800 0.69 ALDH1A1 (0.58) MEN1KMT2AALDH1A1LMNACYP3A4
SCHEMBL3441676 0.66 ALDH1A1 (0.75) MEN1KMT2AALDH1A1LMNACYP3A4
SCHEMBL5718112 0.66 ALDH1A1 (0.67) MEN1KMT2AALDH1A1KDM4ECYP3A4
SCHEMBL6103374 0.66 ALDH1A1 (0.71) ALDH1A1LMNAKDM4ETDP1
SCHEMBL3441634 0.66 ALDH1A1 (0.52) MEN1KMT2AALDH1A1LMNACYP3A4
SCHEMBL3742265 0.66 KMT2A (0.36) MEN1KMT2AALDH1A1LMNAPKM
SCHEMBL25419787 0.65 ALDH1A1 (0.48) MEN1KMT2AALDH1A1LMNACYP3A4

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-20110212973-A1 CARBAMATE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-09-01 US disclosed
EP-2351749-A1 CARBAMATE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-08-03 EP 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-20110212973-A1 CARBAMATE COMPOUND OR SALT THEREOF FAAH, FAAH2, TRPV1 MEN1 3864/4885KMT2A 1097/4885ALDH1A1 1364/4885

“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.