SCHEMBL22700950

SCHEMBL22700950

O=C1N(CCCS)CC(c2ccccc2)N1CCCS

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.41
CHRM3 P20309 1/20 0.41
RIPK1 Q13546 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
BRD4 O60885 3/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 1/20 0.34
RAB9A P51151 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL10851533 0.76 ATM (0.47) RIPK1KMT2AALDH1A1TSHR
SCHEMBL10041560 0.73 RIPK1 (0.42) CHRM2CHRM3RIPK1PRMT5WDR77
SCHEMBL11127083 0.72 CHRM2 (0.47) CHRM2CHRM3PRMT5WDR77KMT2A
SCHEMBL22700947 0.72 TP53 (0.32)
SCHEMBL22700996 0.70 CHRM2 (0.39) CHRM2CHRM3RIPK1PRMT5WDR77
SCHEMBL22728675 0.67 RIPK1 (0.45) RIPK1BRD4KMT2AALDH1A1RAB9A
SCHEMBL11126625 0.66 GAA (0.50) RIPK1ALDH1A1TSHR
SCHEMBL2065162 0.65 GLS (0.42) RAB9A
SCHEMBL2064442 0.65 GLS (0.42) RAB9A
SCHEMBL4429234 0.65 CCR5 (0.41) RIPK1KMT2A

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 CHRM2 4764/4885CHRM3 4763/4885RIPK1 3711/4885
US-11807596-B2 Thiol compounds, synthesis method therefor, and utilization of said thiol compounds TMT1A, CTH, SLC7A11 CHRM2 4764/4885CHRM3 4763/4885RIPK1 3711/4885

“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.