SCHEMBL25868162

SCHEMBL25868162

BC(B)(B)Oc1ccc(-c2ccc3oc(=O)n(CCCO)c3c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
KMO O15229 1/20 0.44
THRB P10828 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TSPO P30536 1/20 0.43
TSHR P16473 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL22314500 0.89 TP53 (0.44) SMN1; SMN2TP53MAPTKMOTHRB
SCHEMBL25868000 0.84 KMO (0.44) SMN1; SMN2TP53MAPTKMOTSPO
SCHEMBL22314474 0.81 KMO (0.46) SMN1; SMN2TP53MAPTKMOTSPO
SCHEMBL25865015 0.77 TP53 (0.47) SMN1; SMN2TP53MAPTKMOTHRB
SCHEMBL25868217 0.76 MAPT (0.46) SMN1; SMN2TP53MAPTKMOTHRB
SCHEMBL22314498 0.76 MAPT (0.53) SMN1; SMN2TP53MAPTKMOTHRB
SCHEMBL25868838 0.74 TMEM97 (0.39) SMN1; SMN2TP53MAPTKMOTHRB
SCHEMBL25865022 0.74 ALDH1A1 (0.46) SMN1; SMN2TP53MAPTKMOTHRB
SCHEMBL22314479 0.74 KMO (0.63) KMOTSPO
SCHEMBL25868038 0.74 ALDH1A1 (0.46) SMN1; SMN2TP53MAPTKMOTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219938-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PREC MEDICINES INC (US) 2023-07-13 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 (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-20230219938-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B SMN1; SMN2 334/4885TP53 4487/4885MAPT 670/4885

“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.