SCHEMBL22413247

SCHEMBL22413247

CC(CO)C(=O)O[C@H](CC(=O)O)C[N+](C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ CYP1A2 P05177 4/20 0.51
▸ MAPK1 P28482 4/20 0.50
▸ MAPT P10636 4/20 0.50
▸ MEN1 O00255 4/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ GMNN O75496 3/20 0.50
▸ NPSR1 Q6W5P4 3/20 0.50
▸ TSHR P16473 3/20 0.50
▸ HSP90AA1 P07900 2/20 0.50
▸ BLM P54132 2/20 0.50
▸ NR1H4 Q96RI1 2/20 0.50
▸ CYP2C9 P11712 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ HIF1A Q16665 1/20 0.50
▸ GLA P06280 1/20 0.49
▸ PMP22 Q01453 1/20 0.49
▸ HRH1 P35367 1/20 0.44
▸ CYP2C19 P33261 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
SCHEMBL21877811 0.87 LMNA (0.60) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL21877806 0.87 LMNA (0.60) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL21647333 0.87 LMNA (0.60) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL5824225 0.85 MEN1 (0.63) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL1643494 0.85 MEN1 (0.63) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL25099265 0.84 LMNA (0.66) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL12137159 0.84 LMNA (0.66) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL12152164 0.84 LMNA (0.66) LMNASMN1; SMN2CYP1A2MAPK1MAPT
Bromide SCHEMBL2995962 0.83 LMNA (0.64) LMNASMN1; SMN2CYP1A2MAPK1MAPT
SCHEMBL20530318 0.83 LMNA (0.64) LMNASMN1; SMN2CYP1A2MAPK1MAPT

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-20240366543-A1 METHODS OF TREATING METHYLMALONIC ACIDEMIA AND PROPIONIC ACIDEMIA HEMOSHEAR THERAPEUTICS INC (US) 2024-11-07 — — US disclosed
EP-4319746-A1 METHODS OF TREATING METHYLMALONIC ACIDEMIA AND PROPIONIC ACIDEMIA Hemoshear Therapeutics, Inc. (US) 2024-02-14 — — EP disclosed
WO-2022216848-A1 METHODS OF TREATING METHYLMALONIC ACIDEMIA AND PROPIONIC ACIDEMIA Hemoshear Therapeutics, Inc. (US) 2022-10-13 — — WO disclosed
US-20220142955-A1 METHODS OF TREATING ORGANIC ACIDEMIAS Hemoshear Therapeutics, Inc. 2022-05-12 — — US disclosed
EP-3937922-A1 METHODS OF TREATING ORGANIC ACIDEMIAS Hemoshear Therapeutics, Inc. (US) 2022-01-19 — — EP disclosed
CN-113557014-A Method for treating organic acidemia 止血治疗有限公司 2021-10-26 — — CN disclosed
WO-2020186216-A1 METHODS OF TREATING ORGANIC ACIDEMIAS HEMOSHEAR THERAPEUTICS, LLC (US) 2020-09-17 — — 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 (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-20240366543-A1 METHODS OF TREATING METHYLMALONIC ACIDEMIA AND PROPIONIC ACIDEMIA MMAB, OTC, ME2 LMNA 1766/4885SMN1; SMN2 100/4885CYP1A2 2193/4885
US-20220142955-A1 METHODS OF TREATING ORGANIC ACIDEMIAS OTC, OAT, PCCA LMNA 1613/4885SMN1; SMN2 576/4885CYP1A2 906/4885

“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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