SCHEMBL24323773

SCHEMBL24323773

Cc1ccc(C)c(S(=O)(=O)N2CCC3(CC2)NCCO3)c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.60
L3MBTL1 Q9Y468 2/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TDP1 Q9NUW8 1/20 0.45
HSD17B10 Q99714 1/20 0.42
KMT2A Q03164 3/20 0.42
USP2 O75604 2/20 0.42
GAA P10253 1/20 0.42
TP53 P04637 1/20 0.41
MEN1 O00255 2/20 0.41

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
SCHEMBL12656056 0.85 CCR1 (0.41) ALDH1A1L3MBTL1SMN1; SMN2KMT2AMEN1
SCHEMBL12625917 0.82 PKM (0.51) ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL24322690 0.81 NPSR1 (0.51) ALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL12624157 0.81 ALDH1A1 (0.42) ALDH1A1L3MBTL1SMN1; SMN2KMT2AGAA
SCHEMBL24322524 0.81 NPC1 (0.49) ALDH1A1RAB9ASMN1; SMN2KMT2AGAA
SCHEMBL12656059 0.81 ALDH1A1 (0.50) ALDH1A1L3MBTL1SMN1; SMN2KMT2AUSP2
SCHEMBL22433209 0.76 ALDH1A1 (0.69) ALDH1A1L3MBTL1RAB9ASMN1; SMN2KMT2A
SCHEMBL10042201 0.76 ALDH1A1 (1.00) ALDH1A1L3MBTL1RAB9ASMN1; SMN2TDP1
SCHEMBL24322801 0.76 NPC1 (0.67) ALDH1A1RAB9ASMN1; SMN2HSD17B10KMT2A
SCHEMBL13035932 0.76 POLB (0.39) ALDH1A1L3MBTL1RAB9ASMN1; SMN2KMT2A

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-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof Psomagen Inc. (US) 2022-04-21 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-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof HTRA1, GIPR, HPN ALDH1A1 4556/4885L3MBTL1 2569/4885RAB9A 435/4885

“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.