SCHEMBL24814430

SCHEMBL24814430

O=C(CS(=O)(=O)c1ccccc1)N1Cc2ccc(F)cc2C1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ POLB P06746 1/20 0.55
▸ HSD11B1 P28845 1/20 0.49
▸ DPP9 Q86TI2 6/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ HSP90B1 P14625 2/20 0.45
▸ TRAP1 Q12931 2/20 0.45
▸ AKR1C3 P42330 1/20 0.45
▸ ROCK2 O75116 1/20 0.44
▸ ROCK1 Q13464 1/20 0.44
▸ NAMPT P43490 2/20 0.44
▸ DPP8 Q6V1X1 5/20 0.44
▸ DPP7 Q9UHL4 5/20 0.44
▸ DPP4 P27487 4/20 0.44

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
SCHEMBL29986546 0.86 SMN1; SMN2 (0.52) SMN1; SMN2POLBHSD11B1NPC1RAB9A
SCHEMBL24817130 0.86 SMN1; SMN2 (0.52) SMN1; SMN2POLBHSD11B1NPC1RAB9A
SCHEMBL29986910 0.86 SMN1; SMN2 (0.67) SMN1; SMN2POLBHSD11B1NPC1RAB9A
SCHEMBL24815673 0.86 SMN1; SMN2 (0.67) SMN1; SMN2POLBHSD11B1NPC1RAB9A
SCHEMBL24815800 0.85 SMN1; SMN2 (0.49) SMN1; SMN2POLBNPC1RAB9AALDH1A1
SCHEMBL29986727 0.85 SMN1; SMN2 (0.49) SMN1; SMN2POLBNPC1RAB9AALDH1A1
SCHEMBL24814454 0.85 DPP9 (0.44) DPP9ALDH1A1HSP90B1TRAP1ROCK2
SCHEMBL29987274 0.82 NAMPT (0.46) DPP9HSP90B1TRAP1ROCK2ROCK1
SCHEMBL24814393 0.82 NAMPT (0.46) DPP9HSP90B1TRAP1ROCK2ROCK1
SCHEMBL24816196 0.79 TAS1R3 (0.50) SMN1; SMN2POLBNPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827629-B2 CDGSH iron sulfur domain 2 activators and use thereof NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2023-11-28 — — US disclosed
US-11827629-B2 CDGSH iron sulfur domain 2 activators and use thereof NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2023-11-28 — — US disclosed
US-20220411418-A1 CDGSH IRON SULFUR DOMAIN 2 ACTIVATORS AND USE THEREOF NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2022-12-29 — — US disclosed
WO-2022251343-A2 CDGSH IRON SULFUR DOMAIN 2 ACTIVATORS AND USE THEREOF NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2022-12-01 — — WO 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-20220411418-A1 CDGSH IRON SULFUR DOMAIN 2 ACTIVATORS AND USE THEREOF CISD2, CISD1, FECH SMN1; SMN2 1176/4885POLB 4115/4885HSD11B1 1364/4885
US-11827629-B2 CDGSH iron sulfur domain 2 activators and use thereof CISD2, CISD1, FECH SMN1; SMN2 1176/4885POLB 4115/4885HSD11B1 1364/4885

“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