SCHEMBL21244041

SCHEMBL21244041

Cc1ccc(S(=O)(=O)Cc2ccccc2N2CCN(c3ccc(Cl)cc3F)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
HTT P42858 6/20 0.47
LMNA P02545 5/20 0.47
ALDH1A1 P00352 4/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PSEN1 P49768 1/20 0.43
PSEN2 P49810 1/20 0.43
APH1B Q8WW43 1/20 0.43
NCSTN Q92542 1/20 0.43
APH1A Q96BI3 1/20 0.43
PSENEN Q9NZ42 1/20 0.43
MAPT P10636 6/20 0.43
DRD2 P14416 1/20 0.43
DRD1 P21728 1/20 0.43
MAPK1 P28482 2/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
DRD4 P21917 1/20 0.42

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
SCHEMBL29772887 0.89 LMNA (0.46) TSHRNPSR1HTTLMNAALDH1A1
SCHEMBL24628362 0.89 LMNA (0.46) TSHRNPSR1HTTLMNAALDH1A1
SCHEMBL29931966 0.86 TSHR (0.43) TSHRNPSR1HTTLMNAALDH1A1
SCHEMBL23536165 0.86 TSHR (0.43) TSHRNPSR1HTTLMNAALDH1A1
SCHEMBL29772926 0.81 ALDH1A1 (0.46) TSHRNPSR1HTTLMNAALDH1A1
SCHEMBL29931916 0.80 KMT2A (0.39) TSHRNPSR1HTTLMNAALDH1A1
SCHEMBL21244030 0.78 MAPT (0.55) TSHRHTTLMNAALDH1A1L3MBTL1
SCHEMBL21261310 0.78 MAPT (0.47) TSHRNPSR1L3MBTL1MAPTMEN1
SCHEMBL21244026 0.77 PSEN1 (0.46) TSHRNPSR1HTTLMNAALDH1A1
SCHEMBL21244043 0.77 C5AR1 (0.50) TSHRNPSR1HTTLMNAALDH1A1

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 TSHR 4022/4885NPSR1 2296/4885HTT 531/4885
US-20190248764-A1 PIPERAZINE DERIVATIVES AS TRPML MODULATORS TRPM5, TRPM2, TRPM4 TSHR 4022/4885NPSR1 2296/4885HTT 531/4885

“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.