SCHEMBL22155012

SCHEMBL22155012

CCC1C[C@@H](S(=O)(=O)c2cc(C(=O)Nc3ncc(Cl)s3)ccc2Cl)C[C@H](C)[C@]1(C)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.39
MEN1 O00255 4/20 0.39
ALDH1A1 P00352 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPK1 P28482 3/20 0.39
HTT P42858 2/20 0.39
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 5/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GLA P06280 1/20 0.38
NOD2 Q9HC29 1/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
GCK P35557 1/20 0.37
KCNH2 Q12809 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 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
SCHEMBL19351675 0.85 STAT3 (0.42) LMNAMEN1ALDH1A1KMT2AMAPK1
SCHEMBL23127148 0.85 ALDH1A1 (0.42) LMNAMEN1ALDH1A1KMT2AMAPK1
SCHEMBL20826923 0.85 GCK (0.42) LMNAMEN1ALDH1A1KMT2AMAPK1
SCHEMBL19351655 0.85 GCK (0.42) LMNAMEN1ALDH1A1KMT2AMAPK1
SCHEMBL19319540 0.85 GCK (0.42) LMNAMEN1ALDH1A1KMT2AMAPK1
SCHEMBL23811941 0.84 KMT2A (0.42) LMNAMEN1ALDH1A1KMT2AMAPK1
SCHEMBL23811795 0.83 ALDH1A1 (0.44) LMNAMEN1ALDH1A1KMT2AMAPK1
SCHEMBL19324976 0.83 HTT (0.39) LMNAMEN1ALDH1A1KMT2AMAPK1
SCHEMBL20826983 0.81 MAPT (0.46) LMNAMEN1ALDH1A1KMT2AMAPK1
SCHEMBL23127281 0.80 RAB9A (0.41) LMNAMEN1ALDH1A1KMT2AMAPK1

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-10934306-B2 Hepatitis B antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2021-03-02 US disclosed
US-20200199143-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARM INC (US) 2020-06-25 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 (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-20200199143-A1 HEPATITIS B ANTIVIRAL AGENTS HAVCR2, PYGL, SLC10A1 LMNA 453/4885MEN1 4731/4885ALDH1A1 3634/4885
US-10934306-B2 Hepatitis B antiviral agents HAVCR2, PYGL, SLC10A1 LMNA 453/4885MEN1 4731/4885ALDH1A1 3634/4885

“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.