SCHEMBL26422749

SCHEMBL26422749

CCC(=O)Oc1ccc(CNC(=O)C(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 1/20 0.51
ERCC4 Q92889 1/20 0.51
ESR1 P03372 2/20 0.50
HIF1A Q16665 2/20 0.50
KMT2A Q03164 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
RECQL P46063 1/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
ELANE P08246 1/20 0.45
MEN1 O00255 3/20 0.44
CARM1 Q86X55 3/20 0.44
PRMT6 Q96LA8 3/20 0.44
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 1/20 0.43
FAAH O00519 1/20 0.43
GAA P10253 2/20 0.42

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
SCHEMBL24668087 0.86 ERCC1 (0.55) ERCC1ERCC4KMT2ASMN1; SMN2NPC1
SCHEMBL26418205 0.84 ERCC1 (0.54) ERCC1ERCC4KMT2ASMN1; SMN2NPC1
SCHEMBL24668340 0.83 ERCC1 (0.53) ERCC1ERCC4KMT2ASMN1; SMN2NPC1
SCHEMBL26698316 0.83 KMT2A (0.53) ESR1HIF1AKMT2ASMN1; SMN2RECQL
SCHEMBL12131750 0.82 ERCC1 (0.70) ERCC1ERCC4KMT2AMEN1GAA
SCHEMBL22060059 0.81 KMT2A (0.62) ERCC1ERCC4KMT2ASMN1; SMN2NPC1
SCHEMBL12757447 0.81 ALDH1A1 (0.62) ERCC1ERCC4KMT2ASMN1; SMN2NPC1
SCHEMBL22060073 0.80 NPC1 (0.62) ERCC1ERCC4KMT2ASMN1; SMN2NPC1
SCHEMBL24558042 0.77 ERCC1 (0.64) ERCC1ERCC4KMT2AMEN1ALDH1A1
SCHEMBL8139001 0.77 L3MBTL1 (0.49) ESR1HIF1AKMT2ASMN1; SMN2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240238436-A1 COMPOSITIONS INCLUDING CONJUGATED THERAPY ENHANCERS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-07-18 US disclosed
US-20230128688-A1 DIRECTED CONJUGATION TECHNOLOGIES KLEO PHARMACEUTICALS, INC. 2023-04-27 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 (2 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-20230128688-A1 DIRECTED CONJUGATION TECHNOLOGIES CD2BP2, CD2, CD47 ERCC1 3649/4885ERCC4 3737/4885ESR1 991/4885
US-20240238436-A1 COMPOSITIONS INCLUDING CONJUGATED THERAPY ENHANCERS LGMN, LPXN, LY96 ERCC1 4251/4885ERCC4 4396/4885ESR1 409/4885

“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.