SCHEMBL26433336

SCHEMBL26433336

CC(C)(C)Cc1cc(CC(C)(C)Cc2ccccc2)ccn1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRN P28799 1/20 0.41
SORT1 Q99523 1/20 0.41
SLC6A2 P23975 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
LMNA P02545 2/20 0.38
CYP2D6 P10635 1/20 0.38
TRPA1 O75762 1/20 0.38
NR3C2 P08235 1/20 0.37
LNPEP Q9UIQ6 4/20 0.35
NOS2 P35228 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CTSK P43235 1/20 0.33

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
SCHEMBL21157383 0.88 FDPS (0.35) GRNSORT1CYP2D6NR3C2LNPEP
SCHEMBL10223946 0.84 ESR1 (0.40) GRNSORT1LMNANR3C2LNPEP
SCHEMBL22905302 0.82 FDPS (0.41) TAAR1LMNACYP2D6HTTSMN1; SMN2
SCHEMBL22762224 0.80 CYP2D6 (0.41) SLC6A2CYP2D6
SCHEMBL18924303 0.77 KDM4E (0.41) LMNALNPEPNOS2
SCHEMBL11926806 0.77 NOS3 (0.52) GRNSORT1LMNATRPA1LNPEP
SCHEMBL21533986 0.76 NOS3 (0.35) LMNANR3C2LNPEPNOS2
SCHEMBL1572105 0.75 SLC6A2 (0.64) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL12561686 0.75 RECQL (0.50) GRNSORT1LMNANR3C2LNPEP
SCHEMBL18714374 0.75 L3MBTL1 (0.45) TAAR1LMNACYP2D6HTTSMN1; SMN2

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-20230132484-A1 STERICALLY HINDERED PHOSPHINE-AMIDE SUPPORTED NICKEL (II) OR PALLADIUM (II) CATALYSTS FOR THE COPOLYMERIZATION OF ETHYLENE AND POLAR COMONOMERS DOW GLOBAL TECHNOLOGIES LLC (US) 2023-05-04 US disclosed
US-20230129371-A1 STERICALLY HINDERED PHOSPHINO-UREA SUPPORTED NICKEL (II) OR PALLADIUM (II) CATALYSTS FOR THE COPOLYMERIZATION OF ETHYLENE AND POLAR COMONOMERS DOW GLOBAL TECHNOLOGIES LLC (US) 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 (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-20230129371-A1 STERICALLY HINDERED PHOSPHINO-UREA SUPPORTED NICKEL (II) OR PALLADIUM (II) CATALYSTS FOR THE COPOLYMERIZATION OF ETHYLENE AND POLAR COMONOMERS PCNA, NIT2, MCM7 GRN 1344/4885SORT1 4107/4885SLC6A2 3202/4885

“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.