SCHEMBL16309672

SCHEMBL16309672

C=CCCC(NC(=O)OCCCC)(C(=O)OCC)C(=O)OCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PKM P14618 2/20 0.47
THRB P10828 1/20 0.47
HTT P42858 1/20 0.46
HPGD P15428 2/20 0.41
TSHR P16473 1/20 0.41
KDM4E B2RXH2 1/20 0.38
EPHX1 P07099 1/20 0.36
ACHE P22303 7/20 0.36
ALDH1A1 P00352 1/20 0.34
NPC1 O15118 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL12292607 0.94 ATM (0.43) ATMMEN1MAPTKMT2AL3MBTL1
SCHEMBL16309674 0.83 HPGD (0.38) ATMMEN1MAPTKMT2AL3MBTL1
SCHEMBL896025 0.82 PKM (0.46) ATMMEN1MAPTKMT2AL3MBTL1
SCHEMBL19055922 0.80 ALDH1A1 (0.39) ATMMEN1MAPTKMT2AL3MBTL1
SCHEMBL866120 0.80 PKM (0.68) ATMMEN1MAPTKMT2AL3MBTL1
SCHEMBL10268738 0.80 HPGD (0.41) ATMHPGDTSHREPHX1ACHE
SCHEMBL10265648 0.78 TSHR (0.42) ATMHPGDTSHREPHX1ACHE
SCHEMBL894596 0.76 PTPN2 (0.53) ATMMEN1KMT2APKMTHRB
SCHEMBL895834 0.76 SMN1; SMN2 (0.40) ATMMEN1MAPTKMT2AL3MBTL1
SCHEMBL10207139 0.73 PKM (0.58) ATMMEN1MAPTKMT2AL3MBTL1

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-20170183362-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS MARS, INCORPORATED 2017-06-29 US disclosed
US-9040703-B2 Inhibitors of arginase and their therapeutic applications MARS, INCORPORATED (US) 2015-05-26 US disclosed
US-20140371175-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS MARS, INCORPORATED 2014-12-18 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-20170183362-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS ARG1, ARG2, PRMT9 ATM 2609/4885MEN1 2806/4885MAPT 4496/4885
US-20140371175-A1 INHIBITORS OF ARGINASE AND THEIR THERAPEUTIC APPLICATIONS ARG1, ARG2, PRMT9 ATM 2609/4885MEN1 2806/4885MAPT 4496/4885

“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.