SCHEMBL7097459

SCHEMBL7097459

COC(=O)CC(=O)C(C)(C)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.46
GAA P10253 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
TSHR P16473 5/20 0.43
HSD17B10 Q99714 3/20 0.40
TET2 Q6N021 1/20 0.38
RECQL P46063 1/20 0.37
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
CA12 O43570 2/20 0.32
CA14 Q9ULX7 2/20 0.32
CA2 P00918 2/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
POLB P06746 1/20 0.31
POLA1 P09884 1/20 0.31

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
SCHEMBL18130134 0.85 MGAM (0.46) MGAMGAASIMGAM2TSHR
SCHEMBL197340 0.82 MGAM (0.48) MGAMGAASIMGAM2TSHR
SCHEMBL23009489 0.81 FAAH (0.35) HSD17B10KMT2AMEN1CA2ALDH1A1
SCHEMBL6248725 0.79 GAA (0.58) MGAMGAASIMGAM2TSHR
SCHEMBL7101659 0.79 MGAM (0.41) MGAMGAASIMGAM2TSHR
SCHEMBL204758 0.79 GAA (0.50) MGAMGAASIMGAM2TSHR
SCHEMBL129536 0.78 MGAM (0.44) MGAMGAASIMGAM2TSHR
SCHEMBL1407070 0.78 MGAM (0.44) MGAMGAASIMGAM2TSHR
SCHEMBL7100983 0.78 LMNA (0.38) TSHRKMT2AMEN1LMNAALDH1A1
SCHEMBL20690118 0.78 MGAM (0.39) MGAMGAASIMGAM2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382856-A1 METHOD OF PRODUCING 3-METHYL-4-HALO-INDOLE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-11-30 US disclosed
EP-4238961-A1 METHOD OF PRODUCING 3-METHYL-4-HALO-INDOLE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2023-09-06 EP disclosed
CN-116368125-A Process for producing 3-methyl-4-halogeno-indole derivative 第一三共株式会社 2023-06-30 CN disclosed
EP-1038861-B1 4-FLUORO-3-OXOCARBOXYLIC ESTERS AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES (JP) 2003-09-03 EP disclosed
US-6593488-B1 Reacting 2-fluorocarboxylate with carboxylate UBE INDUSTRIES, LTD. (JP) 2003-07-15 US disclosed
EP-1038861-A1 4-FLUORO-3-OXOCARBOXYLIC ESTERS AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES LIMITED (JP) 2000-09-27 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-20230382856-A1 METHOD OF PRODUCING 3-METHYL-4-HALO-INDOLE DERIVATIVE INMT, TDO2, HNMT MGAM 1097/4885GAA 3549/4885SI 843/4885

“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.