SCHEMBL23988635

SCHEMBL23988635

C=CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(C(C)C)cc2)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BTK Q06187 6/20 0.52
CYP19A1 P11511 2/20 0.49
KDM4E B2RXH2 1/20 0.48
PGR P06401 1/20 0.48
TGM2 P21980 2/20 0.47
TRIM24 O15164 1/20 0.46
BRD1 O95696 1/20 0.46
BRPF1 P55201 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
FYN P06241 1/20 0.46
SRC P12931 1/20 0.46

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
SCHEMBL23988608 0.89 EPHB4 (0.47) BTKKDM4EPGRTGM2LMNA
SCHEMBL23988609 0.88 BTK (0.47) BTKCYP19A1KDM4ETGM2SMN1; SMN2
SCHEMBL23988634 0.87 TGM2 (0.58) KDM4EPGRTGM2TRIM24BRD1
SCHEMBL9568733 0.86 BTK (0.63) BTKKDM4ETGM2SMN1; SMN2ALDH1A1
SCHEMBL9568677 0.84 TGM2 (0.58) BTKTGM2ALDH1A1PKM
SCHEMBL20885070 0.84 LMNA (0.56) BTKKDM4ETGM2SMN1; SMN2ALDH1A1
SCHEMBL23988607 0.81 PGR (0.54) BTKPGRTGM2ALDH1A1MAPT
SCHEMBL17660300 0.79 EPHB4 (0.61) BTKTGM2FYNSRC
SCHEMBL20885056 0.78 TGM2 (0.63) KDM4ETGM2ALDH1A1LMNAMAPT
SCHEMBL7175064 0.78 HSD17B2 (0.67) CYP19A1KDM4EPGRTRIM24BRD1

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-11155556-B2 Pyrimido-diazepinone kinase scaffold compounds and methods for treating PI3K-mediated disorders DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-10-26 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-11155556-B2 Pyrimido-diazepinone kinase scaffold compounds and methods for treating PI3K-mediated disorders PI4KA, PIK3CA, PI4KB BTK 58/4885CYP19A1 2168/4885KDM4E 2713/4885

“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.