SCHEMBL21244034

SCHEMBL21244034

O=S(=O)(Nc1ccccc1N1CCN(c2ccc(Cl)cc2F)CC1)c1ccc(C(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.53
MCOLN3 Q8TDD5 2/20 0.53
PKM P14618 1/20 0.53
MAPT P10636 5/20 0.51
ALDH1A1 P00352 4/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
MCOLN2 Q8IZK6 1/20 0.46
MCOLN1 Q9GZU1 1/20 0.46
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
GAA P10253 2/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL21244030 0.87 MAPT (0.55) L3MBTL1MCOLN3PKMMAPTALDH1A1
SCHEMBL21244038 0.85 ALDH1A1 (0.54) L3MBTL1MCOLN3PKMMAPTALDH1A1
SCHEMBL21244042 0.84 ALDH1A1 (0.52) L3MBTL1MCOLN3PKMMAPTALDH1A1
SCHEMBL21244031 0.84 MCOLN3 (0.52) L3MBTL1MCOLN3PKMMAPTALDH1A1
SCHEMBL21244051 0.84 MCOLN3 (0.55) L3MBTL1MCOLN3PKMMAPTALDH1A1
SCHEMBL21244040 0.79 ALDH1A1 (0.57) L3MBTL1MCOLN3PKMMAPTALDH1A1
SCHEMBL29931981 0.77 MCOLN2 (0.47) L3MBTL1MCOLN3PKMMAPTALDH1A1
SCHEMBL21244039 0.77 MAPT (0.46) L3MBTL1MCOLN3PKMMAPTALDH1A1
SCHEMBL24628440 0.76 MCOLN2 (0.46) L3MBTL1MCOLN3PKMMAPTALDH1A1
SCHEMBL29772898 0.76 MCOLN2 (0.46) L3MBTL1MCOLN3PKMMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10851084-B2 Piperazine derivatives as TRPML modulators Lysoway Therapeutics, Inc. (US) 2020-12-01 US claimed
US-20190248764-A1 PIPERAZINE DERIVATIVES AS TRPML MODULATORS CalyGene Biotechnolgy, Inc. (US) 2019-08-15 US claimed
US-10851084-B2 Piperazine derivatives as TRPML modulators Lysoway Therapeutics, Inc. (US) 2020-12-01 US disclosed
US-10851084-B2 Piperazine derivatives as TRPML modulators Lysoway Therapeutics, Inc. (US) 2020-12-01 US disclosed
US-20190248764-A1 PIPERAZINE DERIVATIVES AS TRPML MODULATORS CalyGene Biotechnolgy, Inc. (US) 2019-08-15 US disclosed
US-20190248764-A1 PIPERAZINE DERIVATIVES AS TRPML MODULATORS CalyGene Biotechnolgy, Inc. (US) 2019-08-15 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-10851084-B2 Piperazine derivatives as TRPML modulators TRPM5, TRPM2, TRPM4 L3MBTL1 2390/4885MCOLN3 9/4885PKM 546/4885
US-20190248764-A1 PIPERAZINE DERIVATIVES AS TRPML MODULATORS TRPM5, TRPM2, TRPM4 L3MBTL1 2390/4885MCOLN3 9/4885PKM 546/4885

“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.