SCHEMBL24815720

SCHEMBL24815720

O=C(CCS(=O)(=O)c1ccccn1)N1Cc2ccc(F)cc2C1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 5/20 0.45
▸ ROCK2 O75116 1/20 0.42
▸ ROCK1 Q13464 1/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ DPP9 Q86TI2 7/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HSP90B1 P14625 2/20 0.40
▸ TRAP1 Q12931 2/20 0.40
▸ DPP8 Q6V1X1 5/20 0.39
▸ DPP7 Q9UHL4 5/20 0.39
▸ DPP4 P27487 4/20 0.39

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
SCHEMBL29987274 0.89 NAMPT (0.46) NAMPTROCK2ROCK1DPP9HSP90B1
SCHEMBL24814393 0.89 NAMPT (0.46) NAMPTROCK2ROCK1DPP9HSP90B1
SCHEMBL29986739 0.77 NAMPT (0.44) NAMPTROCK1DPP9HSP90B1TRAP1
SCHEMBL24814397 0.77 NAMPT (0.44) NAMPTROCK1DPP9HSP90B1TRAP1
SCHEMBL29987272 0.76 ALDH1A1 (0.50) NAMPTROCK2ROCK1NPC1RAB9A
SCHEMBL24814438 0.76 ALDH1A1 (0.50) NAMPTROCK2ROCK1NPC1RAB9A
SCHEMBL29986903 0.76 ESR1 (0.40) NAMPTNPC1RAB9AALDH1A1
SCHEMBL24815700 0.76 ESR1 (0.40) NAMPTNPC1RAB9AALDH1A1
SCHEMBL24815671 0.76 ALDH1A1 (0.44) NAMPTNPC1RAB9AALDH1A1
SCHEMBL29986504 0.76 ALDH1A1 (0.44) NAMPTNPC1RAB9AALDH1A1

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 NAMPT 2850/4885ROCK2 3702/4885ROCK1 4679/4885
US-11827629-B2 CDGSH iron sulfur domain 2 activators and use thereof CISD2, CISD1, FECH NAMPT 2850/4885ROCK2 3702/4885ROCK1 4679/4885

“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