SCHEMBL31664400

SCHEMBL31664400

CCC(=O)OC(C)c1ccc(OC(C)CC)cc1C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TDP1 Q9NUW8 2/20 0.38
▸ PLA2G1B P04054 1/20 0.38
▸ ATG4B Q9Y4P1 1/20 0.38
▸ FKBP1A P62942 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ ACHE P22303 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ ACACB O00763 3/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ GPR88 Q9GZN0 1/20 0.35

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
SCHEMBL31664450 0.87 SMN1; SMN2 (0.42) SMN1; SMN2TDP1PLA2G1BATG4BFKBP1A
SCHEMBL31664414 0.81 SMN1; SMN2 (0.45) SMN1; SMN2TDP1PLA2G1BATG4BFKBP1A
SCHEMBL31664399 0.80 HIF1A (0.47) MAPTESR1HIF1AACACB
SCHEMBL25454107 0.78 MEN1 (0.42) MAPTESR1HIF1AACHEKDM4E
SCHEMBL31664413 0.78 SMN1; SMN2 (0.41) SMN1; SMN2TDP1PLA2G1BATG4BFKBP1A
SCHEMBL31664434 0.74 SMN1; SMN2 (0.40) SMN1; SMN2TDP1PLA2G1BATG4BFKBP1A
SCHEMBL16672984 0.74 ESR1 (0.41) SMN1; SMN2ESR1ACHEKDM4E
SCHEMBL19122983 0.73 SMN1; SMN2 (0.59) SMN1; SMN2TDP1MAPTACACBKMT2A
SCHEMBL31664418 0.73 CASP1 (0.43) SMN1; SMN2TDP1PLA2G1BATG4BFKBP1A
SCHEMBL3720465 0.72 SMN1; SMN2 (0.46) SMN1; SMN2TDP1MAPTESR1ACACB

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-20250236810-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING BENZENE DERIVATIVES OSMO LABS, PBC 2025-07-24 — — 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-20250236810-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING BENZENE DERIVATIVES BBOX1, NISCH, TAS2R4 SMN1; SMN2 2236/4885TDP1 2932/4885PLA2G1B 3409/4885

“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.

Send feedback