SCHEMBL18863403

SCHEMBL18863403

CC(C)CN1CCC[C@H]1C(=O)NCCC(=O)NCCC(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 1/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ TSHR P16473 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ F2 P00734 4/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MMEL1 Q495T6 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ FKBP1A P62942 1/20 0.40
▸ HRH4 Q9H3N8 1/20 0.40
▸ CTRB1 P17538 1/20 0.40
▸ OPRL1 P41146 2/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ OPRK1 P41145 1/20 0.40

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
SCHEMBL18863404 1.00 PRCP (0.53) PRCPSMN1; SMN2KMT2ATSHRCYP3A4
SCHEMBL18875712 0.91 PRCP (0.51) PRCPSMN1; SMN2KMT2ATSHRCYP3A4
SCHEMBL17335905 0.87 PRCP (0.53) PRCPSMN1; SMN2KMT2ATSHRCYP3A4
SCHEMBL17335904 0.87 PRCP (0.53) PRCPSMN1; SMN2KMT2ATSHRCYP3A4
SCHEMBL17335881 0.87 PRCP (0.54) PRCPSMN1; SMN2KMT2ATSHRCYP3A4
SCHEMBL17335883 0.87 PRCP (0.54) PRCPSMN1; SMN2KMT2ATSHRCYP3A4
SCHEMBL17335929 0.86 PRCP (0.61) PRCPSMN1; SMN2KMT2ATSHRCYP3A4
SCHEMBL17335931 0.86 PRCP (0.61) PRCPSMN1; SMN2KMT2ATSHRCYP3A4
SCHEMBL18875526 0.85 PRCP (0.55) PRCPSMN1; SMN2KMT2ATSHRCYP3A4
SCHEMBL18875626 0.84 PRCP (0.59) PRCPSMN1; SMN2KMT2ATSHRCYP3A4

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
EP-3155436-B1 ISOBARIC MASS LABELS ELECTROPHORETICS LTD (GB) 2023-08-30 — — EP disclosed
US-20170146549-A1 ISOBARIC MASS LABELS ELECTROPHORETICS LIMITED (GB) 2017-05-25 — — 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-20170146549-A1 ISOBARIC MASS LABELS SRMS, PTMS, QPCTL PRCP 821/4885SMN1; SMN2 2823/4885KMT2A 2007/4885

“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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