SCHEMBL25568917

SCHEMBL25568917

CC(C)(C)c1ccc(C(C)(C)CCC(C)(C)c2ccc(C(C)(C)C)cn2)nc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
LOXL2 Q9Y4K0 1/20 0.36
TSHR P16473 1/20 0.34
RAB9A P51151 5/20 0.34
NPC1 O15118 2/20 0.34
LMNA P02545 3/20 0.33
POLB P06746 3/20 0.33
KIF11 P52732 2/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TYR P14679 1/20 0.33
APP P05067 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 2/20 0.33
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
DGAT1 O75907 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
SCHEMBL24926664 0.94 ALDH1A1 (0.37) ALDH1A1LOXL2TSHRRAB9ANPC1
SCHEMBL24926243 0.93 TSHR (0.34) ALDH1A1LOXL2TSHRRAB9ANPC1
SCHEMBL15499726 0.86 LOXL2 (0.36) ALDH1A1LOXL2TSHRRAB9ANPC1
SCHEMBL25878989 0.84 LOXL2 (0.35) ALDH1A1LOXL2TSHRRAB9ANPC1
SCHEMBL27024927 0.83 TSHR (0.34) ALDH1A1LOXL2TSHRRAB9ANPC1
SCHEMBL25805910 0.83 LOXL2 (0.31) ALDH1A1LOXL2RAB9ANPC1L3MBTL1
SCHEMBL25063903 0.83
SCHEMBL24234525 0.82 TSHR (0.40) ALDH1A1LOXL2TSHRRAB9ANPC1
SCHEMBL701703 0.82 TSHR (0.46) ALDH1A1LOXL2TSHRRAB9ANPC1
SCHEMBL19254079 0.82

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-20230227471-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BTK VIA UBIQUITIN PROTEOSOME PATHWAY NURIX THERAPEUTICS, INC. 2023-07-20 US disclosed
US-20230159465-A1 IMMUNOMODULATOR HITGEN INC. (CN) 2023-05-25 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-20230159465-A1 IMMUNOMODULATOR IL2, IL17A, IL2RA ALDH1A1 302/4885LOXL2 2702/4885TSHR 2457/4885
US-20230227471-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BTK VIA UBIQUITIN PROTEOSOME PATHWAY BTK, CBL, XIAP ALDH1A1 4172/4885LOXL2 754/4885TSHR 3966/4885

“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.