Sugi Predict

Sugi Predict / Compounds / SCHEMBL20129593

SCHEMBL20129593

SCHEMBL20129593

CC(C)c1ccccc1[S@@](C)(=N)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ HSD11B1 P28845 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ GABRA1 P14867 2/20 0.40
▸ GABRB2 P47870 2/20 0.40
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ CYP3A4 P08684 3/20 0.37
▸ FAAH O00519 2/20 0.37
▸ TSHR P16473 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ GABRB1 P18505 1/20 0.37
▸ GABRG2 P18507 1/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ HTR2C P28335 1/20 0.37

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
SCHEMBL22187993 1.00 L3MBTL1 (0.48) L3MBTL1HSD11B1POLBGABRA1GABRB2
SCHEMBL20129592 1.00 L3MBTL1 (0.48) L3MBTL1HSD11B1POLBGABRA1GABRB2
SCHEMBL1106525 0.83 L3MBTL1 (0.52) L3MBTL1HSD11B1POLBGABRA1GABRB2
SCHEMBL9379437 0.80 HSD11B1 (0.54) L3MBTL1HSD11B1POLBGABRA1GABRB2
SCHEMBL23773025 0.78 GABRA1 (0.46) L3MBTL1HSD11B1POLBGABRA1GABRB2
SCHEMBL12812603 0.77 L3MBTL1 (0.46) L3MBTL1HSD11B1POLBGABRA1GABRB2
SCHEMBL22927502 0.77 HSD11B1 (0.47) L3MBTL1HSD11B1POLBGABRA1GABRB2
SCHEMBL1106519 0.77 CA1 (0.53) L3MBTL1HSD11B1POLBGABRA1GABRB2
SCHEMBL1415493 0.77 L3MBTL1 (0.46) L3MBTL1HSD11B1POLBGABRA1GABRB2
SCHEMBL3527315 0.77 HSD11B1 (0.47) L3MBTL1HSD11B1POLBGABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10844013-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2020-11-24 — — US disclosed
US-20200207716-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2020-07-02 — — US disclosed
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2019-09-17 — — US disclosed
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2018-05-10 — — US disclosed
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2018-05-10 — — 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 (4 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-10844013-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR L3MBTL1 3865/4885HSD11B1 4796/4885POLB 2449/4885
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR L3MBTL1 3865/4885HSD11B1 4796/4885POLB 2449/4885
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR L3MBTL1 3865/4885HSD11B1 4796/4885POLB 2449/4885
US-20200207716-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR L3MBTL1 3865/4885HSD11B1 4796/4885POLB 2449/4885

“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.