SCHEMBL22387071

SCHEMBL22387071

CC(=O)[C@H](N)CCC(N)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS2 P35228 7/20 0.33
▸ NOS3 P29474 5/20 0.33
▸ NOS1 P29475 5/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ BHMT Q93088 1/20 0.32
▸ BHMT2 Q9H2M3 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ GRIK1 P39086 3/20 0.32
▸ GABRP O00591 2/20 0.32
▸ GABRD O14764 2/20 0.32
▸ GABRA1 P14867 2/20 0.32
▸ GABRB1 P18505 2/20 0.32
▸ GABRG2 P18507 2/20 0.32
▸ GABRB3 P28472 2/20 0.32
▸ GABRA5 P31644 2/20 0.32
▸ GABRA3 P34903 2/20 0.32
▸ GABRA2 P47869 2/20 0.32
▸ GABRB2 P47870 2/20 0.32
▸ GABRA4 P48169 2/20 0.32

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
SCHEMBL24213302 0.84 NOS2 (0.33) NOS2NOS3NOS1KMT2ABHMT
SCHEMBL24125927 0.82 ALDH1A1 (0.37) NOS2NOS3NOS1KMT2ABHMT
SCHEMBL15080395 0.79 SLC1A3 (0.48) NOS2NOS3NOS1BHMTBHMT2
SCHEMBL17164633 0.79 GSR (0.54) NOS2NOS3NOS1KMT2ABHMT
SCHEMBL10069251 0.79 SLC1A3 (0.48) NOS2NOS3NOS1BHMTBHMT2
SCHEMBL12834980 0.78 SLC1A3 (0.34) NOS2NOS3NOS1GRIK1SLC1A3
SCHEMBL22381010 0.78 GSR (0.48) NOS2NOS3NOS1KMT2AMEN1
SCHEMBL9617324 0.78 GSR (0.48) NOS2NOS3NOS1KMT2AMEN1
SCHEMBL28927957 0.77 GABRR1 (0.41) NOS2NOS3NOS1BHMTBHMT2
SCHEMBL18739351 0.76 — —

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-11331331-B2 N4-hydroxycytidine and derivatives and anti-viral uses related thereto EMORY UNIVERSITY (US) 2022-05-17 — — US disclosed
US-11197882-B2 — — 2021-12-14 — — US disclosed
US-11147826-B2 — — 2021-10-19 — — US disclosed
US-20210252033-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-08-19 — — US disclosed
US-20200276219-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-09-03 — — 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 (5 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-11331331-B2 N4-hydroxycytidine and derivatives and anti-viral uses related thereto ENTPD1, NME2, NME1 NOS2 1898/4885NOS3 1753/4885NOS1 1633/4885
US-11147826-B2 — SNRPE, NME2, NME1 NOS2 1869/4885NOS3 1764/4885NOS1 2176/4885
US-20210252033-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO TYMP, MTAP, DCTD NOS2 1678/4885NOS3 1614/4885NOS1 1406/4885
US-20200276219-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO ENTPD1, NME2, NME1 NOS2 1898/4885NOS3 1753/4885NOS1 1633/4885
US-11197882-B2 — SNRPE, NME2, NME1 NOS2 1869/4885NOS3 1764/4885NOS1 2176/4885

“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.

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