SCHEMBL30411911

SCHEMBL30411911

C=Cc1cc(N2C[C@@H]3C[C@H]2CN3C(=O)OC(C)(C)C)ccc1[N+](=O)[O-]

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ F13A1 P00488 1/20 0.45
▸ TGM2 P21980 1/20 0.45
▸ TGM1 P22735 1/20 0.45
▸ HSD11B1 P28845 1/20 0.44
▸ GPR119 Q8TDV5 9/20 0.43
▸ PARP1 P09874 1/20 0.40
▸ HDAC1 Q13547 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RET P07949 2/20 0.35
▸ AR P10275 2/20 0.35
▸ IDH1 O75874 1/20 0.35

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
SCHEMBL30635735 1.00 F13A1 (0.45) F13A1TGM2TGM1HSD11B1GPR119
SCHEMBL30635739 0.85 HSD11B1 (0.46) F13A1TGM2TGM1HSD11B1GPR119
SCHEMBL30411472 0.85 HSD11B1 (0.46) F13A1TGM2TGM1HSD11B1GPR119
SCHEMBL26629221 0.85 CHRNB2 (0.35) ALDH1A1MAPT
SCHEMBL25215803 0.85 CHRNB2 (0.35) ALDH1A1MAPT
SCHEMBL30411352 0.83 HSD11B1 (0.45) F13A1TGM2TGM1HSD11B1GPR119
SCHEMBL30126003 0.83 RET (0.45) F13A1TGM2TGM1HSD11B1GPR119
SCHEMBL11920568 0.82 HSD11B1 (0.43) F13A1TGM2TGM1HSD11B1GPR119
Bicarbonate SCHEMBL30412048 0.81 HSD11B1 (0.43) F13A1TGM2TGM1HSD11B1GPR119
SCHEMBL2718590 0.80 MAPT (0.54) F13A1TGM2TGM1HSD11B1GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250144094-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF ERASCA, INC. 2025-05-08 — — US disclosed
EP-4433059-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF Erasca, Inc. (US) 2024-09-25 — — EP disclosed
WO-2023215494-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF ERASCA, INC. (US) 2023-11-09 — — WO disclosed
WO-2023087027-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF ERASCA, INC. (US) 2023-05-19 — — 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 (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-20250144094-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF ULK1, ULK2, ULK3 F13A1 4774/4885TGM2 541/4885TGM1 392/4885

“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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