SCHEMBL23645902

SCHEMBL23645902

FC(F)(F)c1cnc(N2CCCC(NC(=S)Nc3cccnc3)CC2)c(Cl)c1

nearest known ligand 0.93

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
PKM P14618 1/20 0.54
ALDH1A1 P00352 2/20 0.54
GAA P10253 1/20 0.54
MAPT P10636 1/20 0.54
AGTR1 P30556 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL23111643 0.96 ALDH1A1 (0.57) LMNAPKMALDH1A1GAAMAPT
SCHEMBL23645900 0.87 LMNA (0.64) LMNAPKMALDH1A1GAAMAPT
SCHEMBL23645937 0.87 ALDH1A1 (0.54) ALDH1A1
SCHEMBL23645905 0.86 TRPV1 (0.57) ALDH1A1GAAMAPTAGTR1HTT
SCHEMBL23645910 0.83 ALDH1A1 (0.56) ALDH1A1
SCHEMBL25248113 0.82 ALDH1A1 (0.55) ALDH1A1GAAMAPTAGTR1HTT
SCHEMBL30754327 0.82 ALDH1A1 (0.55) ALDH1A1GAAMAPTAGTR1HTT
SCHEMBL23666090 0.82 ALDH1A1 (0.55) ALDH1A1GAAMAPTAGTR1HTT
SCHEMBL23645916 0.82
SCHEMBL23645953 0.81 ALDH1A1 (0.59) ALDH1A1

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-11897865-B2 ABHD12 inhibitors and methods of making and using same THE SCRIPPS RESEARCH INSTITUTE (US) 2024-02-13 US disclosed
EP-3793552-B1 ABHD12 INHIBITORS AND METHODS OF MAKING AND USING SAME SCRIPPS RESEARCH INST (US) 2023-07-12 EP disclosed
EP-3793552-B1 ABHD12 INHIBITORS AND METHODS OF MAKING AND USING SAME SCRIPPS RESEARCH INST (US) 2023-07-12 EP disclosed
US-20210221790-A1 ABHD12 INHIBITORS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2021-07-22 US disclosed
US-20210221790-A1 ABHD12 INHIBITORS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2021-07-22 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-11897865-B2 ABHD12 inhibitors and methods of making and using same ABHD12, SAMHD1, ABHD11 LMNA 4313/4885PKM 4205/4885ALDH1A1 2729/4885
US-20210221790-A1 ABHD12 INHIBITORS AND METHODS OF MAKING AND USING SAME ABHD12, SAMHD1, ABHD11 LMNA 4313/4885PKM 4205/4885ALDH1A1 2729/4885

“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.