SCHEMBL26529974

SCHEMBL26529974

COc1ccc(S(=O)(=O)N2CCC(Cc3nc(C(C)C)no3)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.52
ABCC1 P33527 1/20 0.52
ABCG2 Q9UNQ0 1/20 0.52
PKM P14618 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MAPT P10636 1/20 0.50
NPC1 O15118 1/20 0.49
PKLR P30613 1/20 0.49
RAB9A P51151 1/20 0.49
GAA P10253 3/20 0.48
ALDH1A1 P00352 4/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
HTT P42858 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
CCR6 P51684 1/20 0.45
TSHR P16473 1/20 0.45
KDM4E B2RXH2 2/20 0.45
USP2 O75604 1/20 0.45

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
SCHEMBL26529968 0.79 SMN1; SMN2 (0.52) ABCB1ABCC1ABCG2SMN1; SMN2MAPT
SCHEMBL17100742 0.78 PKM (0.57) PKMSMN1; SMN2MAPTNPC1PKLR
SCHEMBL17100724 0.73 PKM (0.52) PKMSMN1; SMN2MAPTNPC1PKLR
SCHEMBL15490004 0.72 ABCB1 (0.43) ABCB1ABCC1ABCG2NPC1RAB9A
SCHEMBL23260550 0.71 CHRM2 (0.47) ABCB1ABCC1ABCG2SMN1; SMN2MAPT
SCHEMBL38663566 0.70 ABCB1 (0.51) ABCB1ABCC1ABCG2MAPTNPC1
SCHEMBL23178943 0.70 PKM (0.75) PKMSMN1; SMN2MAPTNPC1PKLR
SCHEMBL1722721 0.69 PKM (1.00) PKMSMN1; SMN2MAPTNPC1PKLR
SCHEMBL31315853 0.69 PKM (1.00) PKMSMN1; SMN2MAPTNPC1PKLR
SCHEMBL7471529 0.69 PKM (0.73) PKMSMN1; SMN2MAPTNPC1PKLR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-10-12 US disclosed
US-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-10-12 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-20230322715-A1 BROAD SPECTRUM ANTI-CANCER COMPOUNDS YTHDF1, YTHDF3, YTHDF2 ABCB1 3325/4885ABCC1 3589/4885ABCG2 1899/4885

“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.