SCHEMBL20164040

SCHEMBL20164040

Nn1cnc(C(=O)O)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.47
TSHR P16473 2/20 0.47
GAA P10253 1/20 0.47
MEN1 O00255 1/20 0.34
PABPC1 P11940 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 2/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
BLM P54132 1/20 0.32
AGER Q15109 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
APOBEC3A P31941 1/20 0.31

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
SCHEMBL28226024 0.78 ALDH1A1 (0.39) PKMTSHRGAAMEN1PABPC1
Methylamine SCHEMBL5149607 0.75 APOBEC3A (0.47) PKMTSHRGAAMEN1PABPC1
SCHEMBL67836 0.74 APOBEC3A (0.50) PKMTSHRGAAMEN1PABPC1
Methylamine SCHEMBL6091448 0.71 PKM (0.57) PKMTSHRGAAMEN1PABPC1
SCHEMBL11652492 0.71 PKM (0.45) PKMTSHRGAAMEN1PABPC1
SCHEMBL9363789 0.69 ALDH1A1 (0.40) TSHRGAAMEN1PABPC1KMT2A
SCHEMBL27667967 0.69 HCAR3 (0.45) PKMTSHRGAAMEN1PABPC1
SCHEMBL19987779 0.69 DPP4 (0.36) ALDH1A1LMNAPTGS1PTGS2
SCHEMBL20366124 0.68 PKM (0.58) PKMTSHRGAAMEN1PABPC1
SCHEMBL70432 0.68 TSHR (0.54) PKMTSHRGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250276300-A1 REDUCTION OF MONOMERIC ISOCYANATES BY POROUS MATERIAL BASF SE (DE) 2025-09-04 US disclosed
EP-4291588-B1 REDUCTION OF MONOMERIC ISOCYANATES BY POROUS MATERIAL BASF SE (DE) 2025-08-20 EP disclosed
EP-4291588-A1 REDUCTION OF MONOMERIC ISOCYANATES BY POROUS MATERIAL BASF SE (DE) 2023-12-20 EP disclosed
CN-116829611-A Reduction of monomeric isocyanates by porous materials 巴斯夫欧洲公司 2023-09-29 CN disclosed
EP-3319966-B1 BICYCLIC HETEROCYCLIC COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME (US) 2020-01-29 EP disclosed
US-10287293-B2 Bicyclic heterocyclic compounds as PDE2 inhibitors MERCK SHARP & DOHME CORP. (US) 2019-05-14 US disclosed
US-20180141952-A1 BICYCLIC HETEROCYCLIC COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-05-24 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-10287293-B2 Bicyclic heterocyclic compounds as PDE2 inhibitors PDE2A, PDE12, PDE4D PKM 439/4885TSHR 2792/4885GAA 230/4885
US-20180141952-A1 BICYCLIC HETEROCYCLIC COMPOUNDS AS PDE2 INHIBITORS PDE2A, PDE12, PDE4D PKM 439/4885TSHR 2792/4885GAA 230/4885

“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.