SCHEMBL23219629

SCHEMBL23219629

O=C1CN(C(=O)OCc2ccccc2)C(=O)O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
MAPK1 P28482 2/20 0.53
GAA P10253 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
P2RX4 Q99571 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
P2RX1 P51575 1/20 0.50
P2RX3 P56373 1/20 0.50
HTR2C P28335 1/20 0.45
CTRB1 P17538 1/20 0.45
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 3/20 0.44
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43

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
SCHEMBL2011989 0.82 MEN1 (0.60) NPC1RAB9ASMN1; SMN2MAPK1GAA
SCHEMBL29235094 0.81 NPC1 (0.61) NPC1RAB9ASMN1; SMN2MAPK1GAA
SCHEMBL11681599 0.78 NAAA (0.60) NPC1RAB9ASMN1; SMN2MAPK1GAA
SCHEMBL12719189 0.74 KMT2A (0.61) NPC1RAB9ASMN1; SMN2MAPK1GAA
SCHEMBL2539997 0.74 NPC1 (0.67) NPC1RAB9ASMN1; SMN2MAPK1GAA
SCHEMBL1800589 0.73 NPC1 (0.53) NPC1RAB9ASMN1; SMN2MAPK1GAA
SCHEMBL14734421 0.73 MEN1 (0.57) NPC1RAB9ASMN1; SMN2MAPK1GAA
SCHEMBL27335331 0.73 HTR2C (0.51) NPC1RAB9ASMN1; SMN2MAPK1GAA
SCHEMBL1488412 0.73 KMT2A (0.60) NPC1RAB9ASMN1; SMN2MAPK1GAA
SCHEMBL20122609 0.72 NPC1 (0.53) NPC1RAB9ASMN1; SMN2MAPK1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3572408-B1 METHOD FOR PURIFYING AN AMINO ACID-N-CARBOXY ANHYDRIDE SHINETSU CHEMICAL CO (JP) 2021-10-27 EP disclosed
US-10975042-B2 Method for purifying an amino acid-n-carboxy anhydride SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-04-13 US disclosed
CN-1022412-C Urethane-protected amino acid-N-carboxylic anhydrides BIORESEARCH INC (US) 1993-10-13 CN disclosed
CN-1040793-A The preparation method of the amino acid-N-carboxyanhydrides of urethane protection BIORESEARCH INC (US) 1990-03-28 CN 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 (1 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-10975042-B2 Method for purifying an amino acid-n-carboxy anhydride NAAA, NPPA, NCAPH NPC1 2050/4885RAB9A 1428/4885SMN1; SMN2 3819/4885

“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.