SCHEMBL22701013

SCHEMBL22701013

Cc1ccc(CCCS)c(OCCCS)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
CYP2C19 P33261 4/20 0.41
CYP1A2 P05177 4/20 0.41
CYP2D6 P10635 1/20 0.41
L3MBTL4 Q8NA19 1/20 0.40
L3MBTL3 Q96JM7 1/20 0.40
L3MBTL1 Q9Y468 9/20 0.39
MAPT P10636 7/20 0.39
RAB9A P51151 5/20 0.39
ATM Q13315 1/20 0.39
HPGD P15428 7/20 0.38
CYP2C9 P11712 4/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 2/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
ALOX12 P18054 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL22701006 0.86 MAPT (0.44) TSHRCYP2C19CYP1A2CYP2D6L3MBTL4
SCHEMBL10039342 0.76 PYCR1 (0.40) MAPTRAB9AALDH1A1MEN1USP2
SCHEMBL22701009 0.76 HDAC3 (0.39) PPARGPPARA
SCHEMBL13433965 0.76 L3MBTL1 (0.42) TSHRCYP2C19CYP1A2L3MBTL4L3MBTL3
SCHEMBL22367628 0.74 HRH1 (0.44) L3MBTL1MAPTATMHPGDNPSR1
SCHEMBL29507667 0.74 HRH1 (0.44) L3MBTL1MAPTATMHPGDNPSR1
SCHEMBL10284332 0.74 ALDH1A1 (0.53) CYP2C19CYP1A2CYP2D6MAPTATM
SCHEMBL22701001 0.72 PDIA6 (0.45) CYP2C19CYP1A2CYP2D6MAPTRAB9A
SCHEMBL31336824 0.71 PPARG (0.35) L3MBTL1MAPTMEN1MAPK1KMT2A
SCHEMBL20663194 0.71 L3MBTL1 (0.54) TSHRCYP2C19CYP1A2L3MBTL4L3MBTL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807596-B2 Thiol compounds, synthesis method therefor, and utilization of said thiol compounds SHIKOKU CHEMICALS CORPORATION (JP) 2023-11-07 US disclosed
US-11807596-B2 Thiol compounds, synthesis method therefor, and utilization of said thiol compounds SHIKOKU CHEMICALS CORPORATION (JP) 2023-11-07 US disclosed
US-20200369606-A1 THIOL COMPOUNDS, SYNTHESIS METHOD THEREFOR, AND UTILIZATION OF SAID THIOL COMPOUNDS SHIKOKU CHEMICALS CORPORATION (JP) 2020-11-26 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-20200369606-A1 THIOL COMPOUNDS, SYNTHESIS METHOD THEREFOR, AND UTILIZATION OF SAID THIOL COMPOUNDS TMT1A, CTH, SLC7A11 TSHR 4698/4885CYP2C19 2587/4885CYP1A2 2366/4885
US-11807596-B2 Thiol compounds, synthesis method therefor, and utilization of said thiol compounds TMT1A, CTH, SLC7A11 TSHR 4698/4885CYP2C19 2587/4885CYP1A2 2366/4885

“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.