SCHEMBL26324979

SCHEMBL26324979

Cc1cc(C)cc(N(c2cc(C)c(F)c(C)c2)C(C(=O)OC(C)C)C(C)C)c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.32
KDM4E B2RXH2 1/20 0.31
AR P10275 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL26325017 0.94 KDM4E (0.34) KDM4ETDP1L3MBTL1
SCHEMBL26325021 0.86 TDP1 (0.31) TSPOKDM4ETDP1L3MBTL1
SCHEMBL20565359 0.86 TSPO (0.33) TSPOKDM4EARTDP1L3MBTL1
SCHEMBL26324961 0.84 L3MBTL1 (0.42) TDP1L3MBTL1
SCHEMBL26324981 0.80 MEN1 (0.38) TSPOTDP1L3MBTL1
SCHEMBL20564573 0.80 KDM4E (0.36) KDM4ETDP1L3MBTL1
SCHEMBL26324909 0.77 PPARG (0.31)
SCHEMBL26324974 0.76 PTGS1 (0.39) TSPO
SCHEMBL26324980 0.76 PDCD1 (0.39) TSPO
SCHEMBL26325018 0.76 ALDH1A1 (0.38) KDM4ETDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11767291-B2 Preparation of secondary amines with electrophilic N-linchpin reagents WILLIAM MARSH RICE UNIVERSITY (US) 2023-09-26 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-11767291-B2 Preparation of secondary amines with electrophilic N-linchpin reagents PNMT, NCL, NPM1 TSPO 3646/4885KDM4E 1342/4885AR 1942/4885

“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.