SCHEMBL19699148

SCHEMBL19699148

COC(=O)[C@H](N)Cc1ccccn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 4/20 0.53
HDAC1 Q13547 2/20 0.53
PTPRA P18433 1/20 0.51
GRIN2D O15399 1/20 0.49
GRIN3B O60391 1/20 0.49
GRIN1 Q05586 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
GRIN3A Q8TCU5 1/20 0.49
FDPS P14324 1/20 0.47
NLRP3 Q96P20 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 1/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.46
DPP4 P27487 2/20 0.45
PGR P06401 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
PTGS1 P23219 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
SCHEMBL30099741 1.00 HDAC6 (0.53) HDAC6HDAC1PTPRAGRIN2DGRIN3B
SCHEMBL10724996 1.00 HDAC6 (0.53) HDAC6HDAC1PTPRAGRIN2DGRIN3B
SCHEMBL2058837 1.00 HDAC6 (0.53) HDAC6HDAC1PTPRAGRIN2DGRIN3B
Hydrochloric Acid SCHEMBL28366685 0.98 HDAC6 (0.52) HDAC6HDAC1PTPRAGRIN2DGRIN3B
Hydrochloric Acid SCHEMBL27539736 0.98 HDAC6 (0.52) HDAC6HDAC1PTPRAGRIN2DGRIN3B
Hydrochloric Acid SCHEMBL5906904 0.98 HDAC6 (0.52) HDAC6HDAC1PTPRAGRIN2DGRIN3B
Hydrochloric Acid SCHEMBL5570822 0.98 HDAC6 (0.52) HDAC6HDAC1PTPRAGRIN2DGRIN3B
SCHEMBL10467278 0.86 PTPRA (0.50) HDAC6HDAC1PTPRAGRIN2DGRIN3B
SCHEMBL1693012 0.86 PTPRA (0.50) HDAC6HDAC1PTPRAGRIN2DGRIN3B
SCHEMBL22445092 0.86 CYP1A2 (0.47) HDAC6HDAC1SMN1; SMN2NPC1LMNA

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-20260109676-A1 HETEROCYCLIC COMPOUNDS AND RELATED METHODS RECURSION PHARMACEUTICALS INC (US) 2026-04-23 US disclosed
US-12528779-B2 Heterocyclic compounds and related methods RECURSION PHARMACEUTICALS, INC. (US) 2026-01-20 US disclosed
US-20240228444-A1 HETEROCYCLIC COMPOUNDS AND RELATED METHODS RECURSION PHARMACEUTICALS, INC. 2024-07-11 US disclosed
US-11919868-B2 Heterocyclic compounds and related methods RECURSION PHARMACEUTICALS, INC. (US) 2024-03-05 US disclosed
EP-4301746-A1 DIAZEPINE DERIVATIVES USEFUL IN THE TREATMENT OF CLOSTRIDIUM DIFFICILE Recursion Pharmaceuticals, Inc. (US) 2024-01-10 EP disclosed
US-20220380323-A1 HETEROCYCLIC COMPOUNDS AND RELATED METHODS RECURSION PHARMACEUTICALS, INC. 2022-12-01 US disclosed
US-11345669-B2 Urea derivatives and methods of use thereof NodThera Limited (GB) 2022-05-31 US disclosed
US-10669242-B2 Clostridium difficile toxin inhibitors Venenum Biodesign, LLC (US) 2020-06-02 US disclosed
US-20200131141-A1 CHEMICAL COMPOUNDS NodThera Limited (GB) 2020-04-30 US disclosed
US-20190194147-A1 Novel Clostridium Difficile Toxin Inhibitors Venenum Biodesign, LLC (US) 2019-06-27 US disclosed
WO-2017214359-A1 NOVEL CLOSTRIDIUM DIFFICILE TOXIN INHIBITORS VENENUM BIODESIGN LLC (US) 2017-12-14 WO 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 (9 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-20260109676-A1 HETEROCYCLIC COMPOUNDS AND RELATED METHODS SLC10A1, SCN1B, HSD3B2 HDAC6 499/4885HDAC1 1591/4885PTPRA 2226/4885
US-20240228444-A1 HETEROCYCLIC COMPOUNDS AND RELATED METHODS CYP11B2, CYP11B1, MAPT HDAC6 165/4885HDAC1 682/4885PTPRA 4011/4885
US-20200131141-A1 CHEMICAL COMPOUNDS IL1B, CASP1, IL1A HDAC6 371/4885HDAC1 414/4885PTPRA 1712/4885
US-12528779-B2 Heterocyclic compounds and related methods SLC10A1, SCN1B, NPY5R HDAC6 784/4885HDAC1 1635/4885PTPRA 2334/4885
US-20190194147-A1 Novel Clostridium Difficile Toxin Inhibitors GABRA5, GABRA1, GABRA4 HDAC6 166/4885HDAC1 1884/4885PTPRA 2405/4885
US-10669242-B2 Clostridium difficile toxin inhibitors GABRA5, GABRA1, GABBR2 HDAC6 226/4885HDAC1 1875/4885PTPRA 2283/4885
US-11345669-B2 Urea derivatives and methods of use thereof IL1B, IL1A, NOD1 HDAC6 1570/4885HDAC1 761/4885PTPRA 4357/4885
US-20220380323-A1 HETEROCYCLIC COMPOUNDS AND RELATED METHODS CYP11B2, CYP11B1, MAPT HDAC6 146/4885HDAC1 1014/4885PTPRA 2572/4885
US-11919868-B2 Heterocyclic compounds and related methods CYP11B2, CYP11B1, MAPT HDAC6 165/4885HDAC1 682/4885PTPRA 4011/4885

“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.