SCHEMBL17335904

SCHEMBL17335904

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

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 1/20 0.53
▸ FKBP1A P62942 4/20 0.46
▸ SMN1; SMN2 Q16637 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
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ HTT P42858 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ OPRL1 P41146 2/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ OPRK1 P41145 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ CPB1 P15086 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
SCHEMBL17335905 1.00 PRCP (0.53) PRCPFKBP1ASMN1; SMN2TSHRCYP3A4
SCHEMBL18863404 0.87 PRCP (0.53) PRCPFKBP1ASMN1; SMN2TSHRCYP3A4
SCHEMBL18863403 0.87 PRCP (0.53) PRCPFKBP1ASMN1; SMN2TSHRCYP3A4
SCHEMBL17335929 0.86 PRCP (0.61) PRCPFKBP1ASMN1; SMN2TSHRCYP3A4
SCHEMBL17335931 0.86 PRCP (0.61) PRCPFKBP1ASMN1; SMN2TSHRCYP3A4
SCHEMBL18875712 0.85 PRCP (0.51) PRCPFKBP1ASMN1; SMN2TSHRCYP3A4
SCHEMBL18875626 0.84 PRCP (0.59) PRCPFKBP1ASMN1; SMN2TSHRCYP3A4
SCHEMBL18875499 0.83 PRCP (0.63) PRCPSMN1; SMN2TSHRCYP3A4MAPT
SCHEMBL17335864 0.83 PRCP (0.63) PRCPSMN1; SMN2TSHRCYP3A4MAPT
SCHEMBL17335883 0.83 PRCP (0.54) PRCPFKBP1ASMN1; SMN2TSHRCYP3A4

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 4 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
EP-3155436-A1 ISOBARIC MASS LABELS Electrophoretics Limited (GB) 2017-04-19 — — EP disclosed
WO-2015189413-A1 ISOBARIC MASS LABELS ELECTROPHORETICS LIMITED (GB) 2015-12-17 — — 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-20170146549-A1 ISOBARIC MASS LABELS SRMS, PTMS, QPCTL PRCP 821/4885FKBP1A 1121/4885SMN1; SMN2 2823/4885

“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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