SCHEMBL24814459

SCHEMBL24814459

O=C(CCS(=O)(=O)c1cccc(F)n1)N1Cc2ccccc2C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.46
▸ RAB9A P51151 6/20 0.40
▸ NPC1 O15118 5/20 0.40
▸ POLB P06746 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ GAA P10253 2/20 0.39
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ HDAC3 O15379 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC10 Q969S8 1/20 0.37
▸ HDAC11 Q96DB2 1/20 0.37
▸ NAMPT P43490 1/20 0.36
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL29986236 1.00 ALDH1A1 (0.46) ALDH1A1RAB9ANPC1POLBSMN1; SMN2
SCHEMBL24815895 0.87 ALDH1A1 (0.41) ALDH1A1RAB9ANPC1POLBSMN1; SMN2
SCHEMBL29986792 0.87 ALDH1A1 (0.41) ALDH1A1RAB9ANPC1POLBSMN1; SMN2
SCHEMBL29987602 0.76 RAB9A (0.65) ALDH1A1RAB9ANPC1POLBSMN1; SMN2
SCHEMBL24814720 0.76 RAB9A (0.65) ALDH1A1RAB9ANPC1POLBSMN1; SMN2
SCHEMBL24815720 0.75 NAMPT (0.45) ALDH1A1RAB9ANPC1NAMPT
SCHEMBL29986937 0.72 ALDH1A1 (0.41) ALDH1A1RAB9ANPC1POLBSMN1; SMN2
SCHEMBL24815717 0.72 ALDH1A1 (0.41) ALDH1A1POLBSMN1; SMN2LMNAHTT
SCHEMBL24814394 0.72 ALDH1A1 (0.41) ALDH1A1RAB9ANPC1POLBSMN1; SMN2
SCHEMBL29986725 0.72 ALDH1A1 (0.41) ALDH1A1POLBSMN1; SMN2LMNAHTT

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-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

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 ALDH1A1 3533/4885RAB9A 2375/4885NPC1 2299/4885
US-11827629-B2 CDGSH iron sulfur domain 2 activators and use thereof CISD2, CISD1, FECH ALDH1A1 3533/4885RAB9A 2375/4885NPC1 2299/4885

“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.

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