SCHEMBL31562706

SCHEMBL31562706

COc1cc(Br)c(C=O)c(OCc2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 1/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ MAPT P10636 3/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ NPC1 O15118 4/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ MAOB P27338 2/20 0.48
▸ ABCB1 P08183 3/20 0.46
▸ LRRK2 Q5S007 1/20 0.46
▸ HTR1A P08908 1/20 0.45
▸ DRD2 P14416 1/20 0.45
▸ ERN1 O75460 2/20 0.44
▸ MAOA P21397 1/20 0.44
▸ PTPN1 P18031 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 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
SCHEMBL13199092 0.92 MAOB (0.50) HDAC8SMN1; SMN2MAPTALDH1A1L3MBTL1
SCHEMBL21957648 0.91 HDAC8 (0.54) HDAC8SMN1; SMN2MAPTL3MBTL1NPC1
SCHEMBL30230244 0.89 SMN1; SMN2 (0.44) HDAC8SMN1; SMN2MAPTALDH1A1L3MBTL1
SCHEMBL26047483 0.86 HDAC8 (0.50) HDAC8SMN1; SMN2MAPTALDH1A1L3MBTL1
SCHEMBL15348526 0.86 ERN1 (0.63) HDAC8SMN1; SMN2MAPTL3MBTL1LMNA
SCHEMBL12581731 0.84 SMN1; SMN2 (0.50) SMN1; SMN2MAPTALDH1A1L3MBTL1LMNA
SCHEMBL29846122 0.83 HDAC8 (0.53) HDAC8SMN1; SMN2LMNAPTPN1
SCHEMBL28491464 0.83 HDAC8 (0.53) HDAC8SMN1; SMN2LMNAPTPN1
SCHEMBL13744497 0.82 SMN1; SMN2 (0.51) HDAC8SMN1; SMN2MAPTALDH1A1L3MBTL1
SCHEMBL23835465 0.82 SMN1; SMN2 (0.49) SMN1; SMN2MAPTALDH1A1L3MBTL1LMNA

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-20250289789-A1 REVERSIBLE LYSINE COVALENT MODIFIERS OF CDK2 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. 2025-09-18 — — US disclosed
WO-2025090658-A2 REVERSIBLE LYSINE COVALENT MODIFIERS OF CDK2 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. (US) 2025-05-01 — — WO 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-20250289789-A1 REVERSIBLE LYSINE COVALENT MODIFIERS OF CDK2 AND USES THEREOF CDK2, CDK20, CDK1 HDAC8 117/4885SMN1; SMN2 2895/4885MAPT 3329/4885

“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.

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