SCHEMBL27114252

SCHEMBL27114252

CC[SH](C)N1CCN(c2cccc(CNC(=N)N)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.43
▸ ITGB3 P05106 2/20 0.41
▸ ITGA2B P08514 2/20 0.41
▸ AGXT P21549 2/20 0.39
▸ LMNA P02545 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ KLKB1 P03952 2/20 0.36
▸ KLK1 P06870 2/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ TRPA1 O75762 1/20 0.35
▸ DRD2 P14416 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
SCHEMBL27113249 0.83 AGXT (0.57) PRMT6ITGB3ITGA2BAGXTLMNA
SCHEMBL27114131 0.80 ITGB3 (0.46) PRMT6ITGB3ITGA2BAGXTLMNA
SCHEMBL27120294 0.80 PRMT6 (0.46) PRMT6ITGB3ITGA2BAGXTLMNA
SCHEMBL27113417 0.80 PRMT6 (0.46) PRMT6ITGB3ITGA2BAGXTLMNA
SCHEMBL27113243 0.78 PRMT6 (0.47) PRMT6ITGB3ITGA2BAGXTLMNA
SCHEMBL27113244 0.78 HTR7 (0.49) PRMT6ITGB3ITGA2BMAPTHTT
SCHEMBL27118870 0.77 PRMT6 (0.46) PRMT6ITGB3ITGA2BAGXTLMNA
SCHEMBL27116714 0.74 F2 (0.41) ITGB3ITGA2BLMNAMEN1KMT2A
SCHEMBL27113245 0.73 SMN1; SMN2 (0.53) ITGB3ITGA2BLMNAMEN1KMT2A
SCHEMBL27116713 0.73 ITGB3 (0.43) PRMT6ITGB3ITGA2BLMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066135-A1 DRUG CONJUGATES AND USES THEREOF SUPERTRANS MEDICAL LTD (IL) 2024-02-29 — — 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 (1 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-20240066135-A1 DRUG CONJUGATES AND USES THEREOF SLC7A1, ABCB11, SLC1A5 PRMT6 1447/4885ITGB3 475/4885ITGA2B 1099/4885

“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.

Send feedback