SCHEMBL21577671

SCHEMBL21577671

CC(C)(C)c1cc(CC(C)(C)c2cccc3nsnc23)c2nsnc2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ POLB P06746 1/20 0.35
▸ KMT2A Q03164 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ TP53 P04637 2/20 0.33
▸ GLA P06280 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ LMNA P02545 3/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ TXNRD1 Q16881 1/20 0.32
▸ TXNRD3 Q86VQ6 1/20 0.32
▸ TXNRD2 Q9NNW7 1/20 0.32

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
SCHEMBL21941492 0.74 KMT2A (0.33) MAPTHSD17B10KDM4EALDH1A1POLB
SCHEMBL19177266 0.74 KDM4E (0.46) MAPTHSD17B10KDM4EHIF1AALDH1A1
SCHEMBL3439599 0.74 MAPT (0.57) MAPTHSD17B10KDM4EHIF1AALDH1A1
SCHEMBL20439222 0.71 KDM4E (0.40) MAPTHSD17B10KDM4EHIF1AALDH1A1
SCHEMBL12775851 0.70 KDM4E (0.47) MAPTHSD17B10KDM4EHIF1AALDH1A1
SCHEMBL28595233 0.68 MAPT (0.42) MAPTHSD17B10KDM4EHIF1AALDH1A1
SCHEMBL21895251 0.68 KDM4E (0.48) MAPTHSD17B10KDM4EHIF1AALDH1A1
SCHEMBL19806082 0.68 TRPV1 (0.35) ALDH1A1POLBKMT2ASMN1; SMN2TSHR
SCHEMBL19176905 0.66 MAPT (0.39) MAPTHSD17B10KDM4EALDH1A1POLB
SCHEMBL762893 0.64 KMT2A (0.56) MAPTHSD17B10KDM4EHIF1AALDH1A1

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-20210300948-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS Frequency Therapeutics, Inc. 2021-09-30 — — US disclosed
US-11066419-B2 1H-pyrrole-2,5-dione compounds and methods of using same Frequency Therapeutics, Inc. (US) 2021-07-20 — — US disclosed
US-20200121681-A1 METHODS FOR HAIR FOLLICLE STEM CELL PROLIFERATION Frequency Therapeutics, Inc. 2020-04-23 — — US disclosed
US-20190352313-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS Frequency Therapeutics, Inc. 2019-11-21 — — 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-20210300948-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS MCL1, PROX1, MKI67 MAPT 4816/4885HSD17B10 2895/4885KDM4E 1302/4885
US-20200121681-A1 METHODS FOR HAIR FOLLICLE STEM CELL PROLIFERATION SHH, GLI1, WNT1 MAPT 3128/4885HSD17B10 746/4885KDM4E 1013/4885
US-11066419-B2 1H-pyrrole-2,5-dione compounds and methods of using same MKI67, PROX1, DCX MAPT 4592/4885HSD17B10 1847/4885KDM4E 401/4885
US-20190352313-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS MCL1, PROX1, MKI67 MAPT 4816/4885HSD17B10 2895/4885KDM4E 1302/4885

“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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