SCHEMBL2120083

SCHEMBL2120083

CCOCCC(=O)NC(C)C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
FAAH O00519 1/20 0.52
MAPK1 P28482 1/20 0.52
ALDH1A1 P00352 4/20 0.41
HPGD P15428 2/20 0.41
TSHR P16473 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NLRP1 Q9C000 1/20 0.39
POLB P06746 2/20 0.38
GAA P10253 1/20 0.37
NAMPT P43490 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36

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
SCHEMBL22425813 0.88 KMT2A (0.58) KMT2AMEN1FAAHMAPK1ALDH1A1
SCHEMBL2119932 0.86 MEN1 (0.55) KMT2AMEN1FAAHMAPK1ALDH1A1
SCHEMBL15887522 0.84 MEN1 (0.53) KMT2AMEN1FAAHMAPK1ALDH1A1
SCHEMBL26419977 0.83 MAPK1 (0.47) KMT2AMEN1FAAHMAPK1ALDH1A1
SCHEMBL2120346 0.82 FAAH (0.61) KMT2AMEN1FAAHMAPK1ALDH1A1
SCHEMBL19782337 0.82 MEN1 (0.46) KMT2AMEN1FAAHMAPK1ALDH1A1
SCHEMBL20078293 0.81 ALDH1A1 (0.38) KMT2AMEN1FAAHMAPK1ALDH1A1
SCHEMBL24212536 0.80 MEN1 (0.44) KMT2AMEN1FAAHMAPK1ALDH1A1
SCHEMBL26003951 0.80 MEN1 (0.44) KMT2AMEN1FAAHMAPK1ALDH1A1
SCHEMBL25083109 0.80 MEN1 (0.44) KMT2AMEN1FAAHMAPK1ALDH1A1

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-8871894-B2 Production method of polyhydroxyimide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-10-28 US disclosed
US-20120094232-A1 PRODUCTION METHOD OF POLYHYDROXYIMIDE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-04-19 US disclosed
US-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 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 (2 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-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP KMT2A 3828/4885MEN1 1549/4885FAAH 4134/4885
US-20120094232-A1 PRODUCTION METHOD OF POLYHYDROXYIMIDE GRHPR, MRPL21, F12 KMT2A 930/4885MEN1 2948/4885FAAH 1572/4885

“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.