SCHEMBL20133625

SCHEMBL20133625

CCc1ccc(F)cc1S(N)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.42
CA12 O43570 2/20 0.42
CA9 Q16790 2/20 0.42
CA1 P00915 1/20 0.42
KDM4E B2RXH2 1/20 0.41
PTGES2 Q9H7Z7 10/20 0.41
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PDIA6 Q15084 1/20 0.38
BRD4 O60885 1/20 0.36
IDO1 P14902 1/20 0.36
AGXT P21549 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
SCHEMBL30507847 1.00 CA2 (0.42) CA2CA12CA9CA1KDM4E
SCHEMBL12215752 0.85 CA2 (0.42) CA2CA12CA9CA1PTGES2
SCHEMBL7433447 0.85 CA2 (0.42) CA2CA12CA9CA1KDM4E
Hydrochloric Acid SCHEMBL2528481 0.83 CA2 (0.41) CA2CA12CA9CA1PTGES2
SCHEMBL2526456 0.83 CA2 (0.41) CA2CA12CA9CA1PTGES2
SCHEMBL14495279 0.83 CA2 (0.41) CA2CA12CA9CA1PTGES2
SCHEMBL13180014 0.82 KDM4E (0.42) KDM4EUSP2SMN1; SMN2
SCHEMBL29054624 0.81 KDM4E (0.41) KDM4EUSP2SMN1; SMN2
SCHEMBL6991911 0.78 KDM4E (0.41) CA2CA12CA9CA1KDM4E
SCHEMBL18741085 0.78 CA2 (0.53) CA2CA12CA9CA1KDM4E

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-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 (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-10414727-B2 Phenyl amino piperidine mTORC inhibitors and uses thereof MTOR, RICTOR, RPTOR CA2 3770/4885CA12 4849/4885CA9 4552/4885
US-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR CA2 3770/4885CA12 4849/4885CA9 4552/4885

“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.