SCHEMBL18686361

SCHEMBL18686361

CCOC(=O)c1ccnc(CN(C(=O)C(F)(F)F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 8/20 0.43
▸ MAPT P10636 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ ATM Q13315 1/20 0.40
▸ USP30 Q70CQ3 3/20 0.40
▸ KDM5B Q9UGL1 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ KDM5A P29375 1/20 0.38
▸ KDM5C P41229 1/20 0.38
▸ KDM4C Q9H3R0 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ PIK3CA P42336 1/20 0.38
▸ HSD11B1 P28845 1/20 0.37

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
SCHEMBL15637367 0.80 MAPT (0.48) GPR119MAPTNPSR1ATMUSP30
SCHEMBL15636742 0.79 SLC6A4 (0.47) KDM5BKDM5AKDM5CKDM4CPIK3CA
SCHEMBL15637003 0.79 UBE2M (0.42) —
SCHEMBL15635959 0.77 MAPT (0.49) MAPTNPSR1ATMUSP30KDM5B
SCHEMBL15635957 0.77 MAPT (0.49) MAPTNPSR1ATMUSP30KDM5B
SCHEMBL15637263 0.74 KDM5B (0.44) MAPTKDM5BMEN1KMT2AKDM5A
SCHEMBL15637130 0.72 PIK3CA (0.42) MAPTNPSR1KDM5BKDM5AKDM5C
Dihydrocinnamaldehyde SCHEMBL15636710 0.70 SLC6A4 (0.42) KDM5BKDM5AKDM5CKDM4C
SCHEMBL24220741 0.70 ALDH1A1 (0.42) GPR119MAPTUSP30MEN1KMT2A
SCHEMBL20951269 0.69 PIK3CA (0.65) GPR119MAPTATMPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107434803-B Inhibitors of histone demethylases 吉利德科学公司 2020-05-05 — — CN disclosed
US-10221139-B2 Inhibitors of histone demethylases GILEAD SCIENCES, INC. (US) 2019-03-05 — — US disclosed
EP-3150582-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. (US) 2017-04-05 — — EP 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-10221139-B2 Inhibitors of histone demethylases EHMT1, KDM1B, EHMT2 GPR119 1435/4885MAPT 3027/4885NPSR1 4188/4885

“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.

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