SCHEMBL23303256

SCHEMBL23303256

CNC(=O)OCC(CO)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ PRKCA P17252 2/20 0.47
▸ PRKCD Q05655 2/20 0.47
▸ ATM Q13315 1/20 0.44
▸ KMT2A Q03164 1/20 0.43
▸ F9 P00740 1/20 0.43
▸ F10 P00742 1/20 0.43
▸ PLAU P00749 1/20 0.43
▸ SLC6A3 Q01959 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ MTNR1A P48039 1/20 0.39
▸ MTNR1B P49286 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
SCHEMBL27446892 0.87 CYP1A2 (0.56) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL24574540 0.84 CYP1A2 (0.76) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL8099464 0.84 SMN1; SMN2 (0.51) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL8099913 0.84 SMN1; SMN2 (0.51) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL742603 0.81 CYP1A2 (0.56) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL8103307 0.81 CYP1A2 (0.56) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL2705027 0.81 CYP1A2 (0.56) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL2705028 0.81 CYP1A2 (0.56) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
Carbamic Acid SCHEMBL7775520 0.81 CYP1A2 (0.53) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1
SCHEMBL19553463 0.80 CYP1A2 (0.51) CYP1A2CYP2D6PKMSMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002367-A1 BIFUNCTIONAL COMPOUNDS C4 THERAPEUTICS, INC. 2023-01-05 — — US disclosed
EP-4054724-A1 BIFUNCTIONAL COMPOUNDS F. Hoffmann-La Roche AG (CH) 2022-09-14 — — EP disclosed
WO-2021086785-A1 BIFUNCTIONAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2021-05-06 — — 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-20230002367-A1 BIFUNCTIONAL COMPOUNDS ITCH, EGFR, MUC1 CYP1A2 1204/4885CYP2D6 866/4885PKM 4777/4885

“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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