SCHEMBL25433686

SCHEMBL25433686

O=C(O)NCCN(CCNC(=O)O)c1nc2ccc(Br)cc2o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 1/20 0.41
ALDH1A1 P00352 4/20 0.39
HPGD P15428 2/20 0.39
ALOX12 P18054 1/20 0.39
TP53 P04637 3/20 0.38
LMNA P02545 1/20 0.38
KDM4E B2RXH2 3/20 0.36
AKR1B1 P15121 1/20 0.36
GAA P10253 1/20 0.36
CYP1A2 P05177 1/20 0.36
MAPT P10636 2/20 0.35
RXFP1 Q9HBX9 2/20 0.35
EGLN1 Q9GZT9 1/20 0.35
PIM1 P11309 1/20 0.34
PPARG P37231 3/20 0.34
GLA P06280 1/20 0.34
POLB P06746 1/20 0.34
NR4A1 P22736 1/20 0.34
RECQL P46063 1/20 0.34
MCL1 Q07820 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
SCHEMBL29437045 0.83 KDM4E (0.40) ALDH1A1HPGDALOX12LMNAKDM4E
SCHEMBL26554329 0.83 KDM4E (0.40) ALDH1A1HPGDALOX12LMNAKDM4E
SCHEMBL25398287 0.78 MAPT (0.48) DAGLATP53LMNAKDM4EAKR1B1
SCHEMBL25436533 0.78 PPARG (0.49) TP53PPARGPPARAPPARD
SCHEMBL25401846 0.77 HDAC6 (0.42) DAGLAALDH1A1HPGDTP53KDM4E
SCHEMBL25399446 0.76 MAPT (0.47) DAGLATP53LMNAKDM4EAKR1B1
SCHEMBL25401093 0.75 DAGLA (0.43) DAGLAALDH1A1HPGDTP53KDM4E
SCHEMBL17763532 0.71 TP53 (0.43) ALDH1A1HPGDALOX12TP53LMNA
SCHEMBL13826906 0.70 ELANE (0.49) DAGLAALDH1A1HPGDKDM4EAKR1B1
SCHEMBL3638526 0.68 DAGLA (0.56) DAGLAALDH1A1HPGDKDM4EAKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230331683-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. 2023-10-19 US disclosed
EP-4211111-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY University of Virginia Patent Foundation (US) 2023-07-19 EP 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-20230331683-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY SPNS2, SPCS2, SMN1; SMN2 DAGLA 4856/4885ALDH1A1 3088/4885HPGD 2679/4885

“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.