SCHEMBL26212925

SCHEMBL26212925

CCC(C)c1ccc(S(=O)(=O)NCCCl)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA12 O43570 2/20 0.46
CA9 Q16790 2/20 0.46
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SIGMAR1 Q99720 2/20 0.42
OPRK1 P41145 1/20 0.42
PKM P14618 1/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 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
SCHEMBL8388722 0.87 CA12 (0.62) ALDH1A1CA1CA2CA12CA9
SCHEMBL26212905 0.87 ALDH1A1 (0.53) ALDH1A1CA1CA2CA12CA9
SCHEMBL26212901 0.78 ALDH1A1 (0.53) ALDH1A1CA1CA2CA12CA9
SCHEMBL1504601 0.78 ALDH1A1 (0.66) ALDH1A1CA2CA12CA9MEN1
SCHEMBL15835045 0.78 SMN1; SMN2 (0.53) ALDH1A1CA1CA2CA12CA9
SCHEMBL26212908 0.77 ALDH1A1 (0.69) ALDH1A1MEN1KMT2AKDM4ELMNA
SCHEMBL12646343 0.77 CA1 (0.47) ALDH1A1CA1CA2CA12CA9
SCHEMBL13138375 0.77 ALDH1A1 (0.49) ALDH1A1CA1CA2CA12CA9
SCHEMBL26212922 0.76 ALDH1A1 (0.51) ALDH1A1MEN1KMT2APKMKDM4E
SCHEMBL13508608 0.76 CA1 (0.50) ALDH1A1CA1CA2CA12CA9

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
CN-115843271-B Indole derivatives and their use for the treatment of cancer 克洛德贝纳尔-里昂第一大学 2024-08-13 CN disclosed
US-20230278983-A1 INDOLE DERIVATIVES AND USES THEREOF FOR TREATING A CANCER UNIVERSITE CLAUDE BERNARD LYON 1 (FR) 2023-09-07 US disclosed
US-20230278983-A1 INDOLE DERIVATIVES AND USES THEREOF FOR TREATING A CANCER UNIVERSITE CLAUDE BERNARD LYON 1 (FR) 2023-09-07 US disclosed
CN-115843271-A Indole derivatives and their use for the treatment of cancer 克洛德贝纳尔-里昂第一大学 2023-03-24 CN 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-20230278983-A1 INDOLE DERIVATIVES AND USES THEREOF FOR TREATING A CANCER CSNK2A1, IDO1, CSNK2A3 ALDH1A1 995/4885CA1 689/4885CA2 342/4885

“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.