SCHEMBL21552898

SCHEMBL21552898

O=c1c(N2CC3(COC3)C2)nc(CCCO)cn1-c1ccc(-n2ccnn2)cc1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.34
KCNJ1 P48048 1/20 0.33
NOTUM Q6P988 3/20 0.33
SYK P43405 1/20 0.32
PFKFB3 Q16875 1/20 0.31
CYP19A1 P11511 1/20 0.31
GRIA1 P42261 1/20 0.31
CMA1 P23946 1/20 0.30
JAK2 O60674 1/20 0.30
ROCK2 O75116 1/20 0.30
GSK3B P49841 1/20 0.30

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
SCHEMBL21553052 0.87 NOTUM (0.33) KDM1AKCNJ1NOTUMSYKGRIA1
SCHEMBL21564806 0.86 MAPK8 (0.37) NOTUMSYKCYP19A1
SCHEMBL21553078 0.85 DUT (0.36) KDM1AKCNJ1SYKCYP19A1
SCHEMBL21553071 0.84 GRIA1 (0.38) SYKPFKFB3GRIA1
SCHEMBL21552999 0.84 NOTUM (0.35) KDM1AKCNJ1NOTUMCYP19A1CMA1
SCHEMBL21552994 0.82 SYK (0.37) SYKGRIA1
SCHEMBL21552997 0.82 EP300 (0.40) NOTUMSYK
SCHEMBL21552993 0.82 NOTUM (0.34) KDM1ANOTUMSYKCYP19A1CMA1
SCHEMBL21552868 0.81 PTGS2 (0.41) SYKPFKFB3
SCHEMBL21553047 0.80 CMA1 (0.34) KDM1ANOTUMCYP19A1CMA1JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11932629-B2 KDM1A inhibitors for the treatment of disease IMAGO BIOSCIENCES, INC. (US) 2024-03-19 US disclosed
US-20230250090-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES INC (US) 2023-08-10 US disclosed
US-20230250090-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES INC (US) 2023-08-10 US disclosed
US-20230250090-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES INC (US) 2023-08-10 US disclosed
US-11578059-B2 KDM1A inhibitors for the treatment of disease Imago Biosciences. Inc. (US) 2023-02-14 US disclosed
US-11578059-B2 KDM1A inhibitors for the treatment of disease Imago Biosciences. Inc. (US) 2023-02-14 US disclosed
US-20210115023-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES, INC. 2021-04-22 US disclosed
US-20210115023-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES, INC. 2021-04-22 US disclosed
EP-3790867-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE Imago Biosciences Inc. (US) 2021-03-17 EP disclosed
WO-2019217972-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE IMAGO BIOSCIENCES, INC. (US) 2019-11-14 WO disclosed
US-9522931-B2 Process for the preparation of compounds useful as inhibitors of SGLT-2 JANSSEN PHARMACEUTICA NV (BE) 2016-12-20 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 (4 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-11932629-B2 KDM1A inhibitors for the treatment of disease KDM1B, KDM1A, KDM2A KDM1A 2/4885KCNJ1 3033/4885NOTUM 4680/4885
US-20230250090-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE KDM1B, KDM1A, KDM2A KDM1A 2/4885KCNJ1 3033/4885NOTUM 4680/4885
US-20210115023-A1 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE KDM1A, KDM1B, KDM2A KDM1A 1/4885KCNJ1 2628/4885NOTUM 4635/4885
US-11578059-B2 KDM1A inhibitors for the treatment of disease KDM1B, KDM1A, KDM2A KDM1A 2/4885KCNJ1 3033/4885NOTUM 4680/4885

“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.