SCHEMBL20133705

SCHEMBL20133705

CC(C)c1cccc(F)c1[S@@](C)(=N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
PKM P14618 1/20 0.38
PKLR P30613 1/20 0.38
GABRA1 P14867 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
FAAH O00519 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
GABRB1 P18505 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
HTR2C P28335 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36

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
SCHEMBL20129738 1.00 L3MBTL1 (0.40) L3MBTL1PKMPKLRGABRA1GABRG2
SCHEMBL22693113 0.86 KEAP1 (0.33) L3MBTL1KAT6A
SCHEMBL20073207 0.85 L3MBTL1 (0.42) L3MBTL1PKMPKLRGABRA1GABRG2
SCHEMBL20129739 0.80 CA1 (0.44) L3MBTL1PKMPKLRGABRA1GABRG2
SCHEMBL20129598 0.80 L3MBTL1 (0.41) L3MBTL1GABRA1GABRG2GABRB3FAAH
SCHEMBL20129596 0.80 L3MBTL1 (0.41) L3MBTL1GABRA1GABRG2GABRB3FAAH
SCHEMBL23139059 0.78 GABRA1 (0.39) L3MBTL1PKMPKLRGABRA1GABRG2
SCHEMBL22187863 0.76 ACHE (0.43) PKMPKLRLMNATSHRPOLB
SCHEMBL20149756 0.76 ACHE (0.43) PKMPKLRLMNATSHRPOLB
SCHEMBL20073210 0.72 POLB (0.38) L3MBTL1GABRA1GABRG2GABRB3FAAH

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
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

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 3865/4885PKM 564/4885PKLR 2651/4885
US-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR L3MBTL1 3865/4885PKM 564/4885PKLR 2651/4885
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR L3MBTL1 3865/4885PKM 564/4885PKLR 2651/4885
US-20200207716-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR L3MBTL1 3865/4885PKM 564/4885PKLR 2651/4885

“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.