SCHEMBL5385064

SCHEMBL5385064

C[C@@H](c1ccccc1)N1C[C@H]1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.53
CHRM2 P08172 3/20 0.48
CHRM4 P08173 3/20 0.48
CHRM5 P08912 3/20 0.48
CHRM1 P11229 3/20 0.48
CHRM3 P20309 3/20 0.48
CYP2D6 P10635 2/20 0.46
AGTR2 P50052 1/20 0.42
ALDH1A1 P00352 3/20 0.41
CCR5 P51681 1/20 0.41
MC4R P32245 1/20 0.41
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL5379789 1.00 KMT2A (0.53) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL5379214 1.00 KMT2A (0.53) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL295762 1.00 KMT2A (0.53) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL5379742 1.00 KMT2A (0.53) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL12087990 0.88 CHRM2 (0.50) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL12151312 0.88 CHRM2 (0.50) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL5011861 0.86 KMT2A (0.47) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL11146489 0.86 KMT2A (0.47) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL26645908 0.85 KMT2A (0.47) KMT2ACHRM2CHRM4CHRM5CHRM1
SCHEMBL12091646 0.83 CHRM2 (0.47) KMT2ACHRM2CHRM4CHRM5CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7268228-B2 Optically active aziridine-2-carboxylate derivatives and a process for preparing them IMAGENE CO., LTD. (KR) 2007-09-11 US disclosed
EP-1309550-A4 OPTICALLY ACTIVE AZIRIDINE-2-CARBOXYLATE DERIVATIVES AND A PROCESS FOR PREPARING THEM CHEMBIONEX CO LTD (KR) 2004-07-07 EP disclosed
US-20040030133-A1 Optically active aziridine-2-carboxylate derivatives and a process for preparing them IMAGENE CO. LTD. (KR) 2004-02-12 US disclosed
EP-1309550-A1 OPTICALLY ACTIVE AZIRIDINE-2-CARBOXYLATE DERIVATIVES AND A PROCESS FOR PREPARING THEM Chembionex Co., Ltd (KR) 2003-05-14 EP disclosed
WO-2002012186-A1 OPTICALLY ACTIVE AZIRIDINE-2-CARBOXYLATE DERIVATIVES AND A PROCESS FOR PREPARING THEM CHEMBIONEX CO., LTD. (KR) 2002-02-14 WO 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-20040030133-A1 Optically active aziridine-2-carboxylate derivatives and a process for preparing them HRH2, HRH1, DDC KMT2A 648/4885CHRM2 13/4885CHRM4 22/4885

“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.