SCHEMBL26212905

SCHEMBL26212905

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

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
RAB9A P51151 1/20 0.49
CA1 P00915 4/20 0.49
CA2 P00918 4/20 0.49
TSHR P16473 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CA12 O43570 3/20 0.49
CA9 Q16790 3/20 0.49
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP3A4 P08684 1/20 0.46
HTT P42858 1/20 0.46
KDM4E B2RXH2 1/20 0.45
PKM P14618 1/20 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
SCHEMBL26212925 0.87 ALDH1A1 (0.47) ALDH1A1RAB9ACA1CA2TSHR
SCHEMBL9229020 0.84 CA1 (0.69) ALDH1A1RAB9ACA1CA2TSHR
SCHEMBL23693484 0.83 CYP3A4 (0.69) ALDH1A1RAB9ACA1CA2TSHR
SCHEMBL7039693 0.83 ALDH1A1 (0.58) ALDH1A1RAB9ACA1CA2CA12
SCHEMBL7023027 0.82 TSHR (0.64) ALDH1A1CA1CA2TSHRNPSR1
SCHEMBL9228822 0.81 LMNA (0.56) ALDH1A1RAB9ACA1CA2TSHR
SCHEMBL1504601 0.80 ALDH1A1 (0.66) ALDH1A1CA2CA12CA9LMNA
SCHEMBL9231104 0.80 ALDH1A1 (0.63) ALDH1A1CA1CA2CA12CA9
SCHEMBL4182181 0.80 CYP3A4 (0.70) CA1CA2TSHRCA12CA9
SCHEMBL19454404 0.80 ALDH1A1 (0.71) ALDH1A1RAB9ATSHRLMNASMN1; SMN2

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 995/4885RAB9A 4059/4885CA1 689/4885

“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.