SCHEMBL26422908

SCHEMBL26422908

CC(C)NC(=O)OCc1cc(F)c(OC(=O)C(C)C)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 2/20 0.41
TOP2B Q02880 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
ATM Q13315 1/20 0.36
CTSK P43235 4/20 0.36
CYP3A4 P08684 3/20 0.36
TSHR P16473 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
TPSAB1 Q15661 2/20 0.35
PLG P00747 1/20 0.35
PRSS1 P07477 1/20 0.35
ALOX15 P16050 1/20 0.35
ADRB2 P07550 1/20 0.35
ADRA2A P08913 1/20 0.35
DRD2 P14416 1/20 0.35
ADRA2C P18825 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
SCHEMBL23417785 0.89 TOP2A (0.41) TOP2ATOP2BSMN1; SMN2LMNAMAPT
SCHEMBL26428984 0.87 ADRB2 (0.38) TOP2ATOP2BSMN1; SMN2CTSKCYP3A4
SCHEMBL29344415 0.86 TOP2A (0.40) TOP2ATOP2BSMN1; SMN2LMNAMAPT
SCHEMBL26417663 0.85 ALOX15 (0.40) SMN1; SMN2LMNAMAPTNPC1RAB9A
SCHEMBL29344082 0.80 TOP2A (0.38) TOP2ATOP2BSMN1; SMN2LMNAMAPT
SCHEMBL26446048 0.79 ALOX15 (0.35) ALOX15ADRB2ADRA2ADRD2ADRA2C
SCHEMBL23417787 0.78 LMNA (0.43) TOP2ATOP2BSMN1; SMN2LMNAMAPT
SCHEMBL24668089 0.75 ALOX15 (0.34) SMN1; SMN2LMNAMAPTNPC1RAB9A
SCHEMBL26428982 0.75 TOP2A (0.55) TOP2ATOP2BATMCTSKCYP3A4
SCHEMBL23417763 0.75 CYP4F2 (0.45) TOP2ATOP2BSMN1; SMN2LMNAHPGD

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 TOP2A 1150/4885TOP2B 2171/4885SMN1; SMN2 1694/4885
US-20240238436-A1 COMPOSITIONS INCLUDING CONJUGATED THERAPY ENHANCERS LGMN, LPXN, LY96 TOP2A 681/4885TOP2B 1152/4885SMN1; SMN2 2948/4885

“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.