SCHEMBL21086976

SCHEMBL21086976

CCCC(C)C(=O)NC(CSSC(C)(C)C)C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ METAP2 P50579 4/20 0.39
▸ METAP1 P53582 4/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ACE P12821 1/20 0.32
▸ CNR1 P21554 2/20 0.32

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
SCHEMBL21086903 0.89 CYP1A2 (0.41) CYP1A2CYP2C9CYP2C19HTTMETAP2
SCHEMBL21086900 0.86 CYP1A2 (0.43) CYP1A2CYP2C9CYP2C19HTTMETAP2
SCHEMBL19924329 0.80 CYP1A2 (0.45) CYP1A2CYP2C9CYP2C19HTTMETAP2
SCHEMBL16626925 0.68 CYP1A2 (0.64) CYP1A2CYP2C9CYP2C19HTTSMN1; SMN2
SCHEMBL7615739 0.68 METAP2 (0.55) CYP1A2CYP2C9CYP2C19HTTMETAP2
SCHEMBL3765470 0.68 METAP2 (0.55) CYP1A2CYP2C9CYP2C19HTTMETAP2
SCHEMBL19924408 0.67 METAP2 (0.41) CYP1A2CYP2C9CYP2C19HTTMETAP2
SCHEMBL12438545 0.67 CYP1A2 (0.72) CYP1A2CYP2C9CYP2C19HTTSMN1; SMN2
SCHEMBL2953811 0.67 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19HTTSMN1; SMN2
SCHEMBL2953807 0.67 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19HTTSMN1; SMN2

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-12037358-B2 Compositions comprising reversibly modified oligonucleotides and uses thereof DICERNA PHARMACEUTICALS, INC. (US) 2024-07-16 — — US disclosed
US-20190177355-A1 COMPOSITIONS COMPRISING REVERSIBLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF NOVO NORDISK A/S (DK) 2019-06-13 — — 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 (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-20190177355-A1 COMPOSITIONS COMPRISING REVERSIBLY MODIFIED OLIGONUCLEOTIDES AND USES THEREOF GSS, GSR, RNMT CYP1A2 4654/4885CYP2C9 3232/4885CYP2C19 4121/4885
US-12037358-B2 Compositions comprising reversibly modified oligonucleotides and uses thereof GSS, GSR, RNMT CYP1A2 4654/4885CYP2C9 3232/4885CYP2C19 4121/4885

“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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