SCHEMBL25958466

SCHEMBL25958466

CC(=O)n1nc(Br)c(C(=O)Nc2ccc(C)cc2F)n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
FLT1 P17948 5/20 0.43
KDR P35968 5/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
LMNA P02545 3/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DHFR P00374 1/20 0.42
KMT2A Q03164 1/20 0.42
AHR P35869 1/20 0.41
RIPK1 Q13546 1/20 0.41
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.38

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
SCHEMBL22257201 0.89 NPC1 (0.58) NPC1RAB9AL3MBTL1LMNASMN1; SMN2
SCHEMBL25958469 0.88 FLT1 (0.45) NPC1RAB9AL3MBTL1FLT1KDR
SCHEMBL25958463 0.85 FLT1 (0.43) NPC1RAB9AL3MBTL1FLT1KDR
SCHEMBL25958459 0.85 POLB (0.49) NPC1RAB9AL3MBTL1LMNANFKB1
SCHEMBL25958481 0.84 NPC1 (0.43) NPC1RAB9AL3MBTL1FLT1KDR
SCHEMBL25958707 0.82 NPC1 (0.45) NPC1RAB9AL3MBTL1FLT1KDR
SCHEMBL25958688 0.82 NPC1 (0.45) NPC1RAB9AL3MBTL1FLT1KDR
SCHEMBL22257192 0.80 ALOX15 (0.59) NPC1RAB9ALMNARIPK1
SCHEMBL25958305 0.80 L3MBTL1 (0.46) NPC1RAB9AL3MBTL1FLT1KDR
SCHEMBL25958418 0.79 NPC1 (0.45) NPC1RAB9AL3MBTL1FLT1KDR

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-20230248752-A1 PRODRUGS OF ALOX-15 INHIBITORS AND METHODS OF USING THE SAME EMPIRICO INC. 2023-08-10 US disclosed
US-11666588-B2 Prodrugs of ALOX-15 inhibitors and methods of using the same EMPIRICO INC. (US) 2023-06-06 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-20230248752-A1 PRODRUGS OF ALOX-15 INHIBITORS AND METHODS OF USING THE SAME ALOX15, ALOX5, ALOX15B NPC1 2279/4885RAB9A 4106/4885L3MBTL1 2134/4885
US-11666588-B2 Prodrugs of ALOX-15 inhibitors and methods of using the same ALOX15, ALOX5, ALOX15B NPC1 2279/4885RAB9A 4106/4885L3MBTL1 2134/4885

“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.