SCHEMBL8430356

SCHEMBL8430356

CCc1ccc(C(C)(C)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
TAAR1 Q96RJ0 2/20 0.41
KIF11 P52732 2/20 0.40
LMNA P02545 1/20 0.40
CYP2A6 P11509 1/20 0.39
LPL P06858 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
PLK1 P53350 1/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
HPGD P15428 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CA2 P00918 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ESR1 P03372 1/20 0.36

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
SCHEMBL11932056 0.85 TP53 (0.42) TP53TAAR1KIF11LMNACYP2A6
SCHEMBL91061 0.82 TAAR1 (0.54) TP53TAAR1KIF11ALDH1A1KMT2A
SCHEMBL12199951 0.81 TP53 (0.39) TP53TAAR1KIF11LMNACYP2A6
SCHEMBL14433047 0.81 TP53 (0.39) TP53TAAR1KIF11LMNACYP2A6
SCHEMBL10235460 0.81 PDE2A (0.48) TP53TAAR1KIF11LMNACYP2A6
SCHEMBL5754177 0.81 TP53 (0.39) TP53TAAR1KIF11LMNACYP2A6
SCHEMBL14393590 0.81 LPL (0.43) TAAR1LPLLIPGPLK1ALDH1A1
SCHEMBL497773 0.81 HSD11B1 (0.43) KIF11LMNAALDH1A1HPGDMEN1
Ammonia Solution, Strong SCHEMBL266277 0.80 TAAR1 (0.52) TP53TAAR1KIF11PLK1ALDH1A1
SCHEMBL9074271 0.79 MAOB (0.41) TP53TAAR1KIF11LMNACYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303625-A1 CYCLIC POLYPEPTIDES FOR PCSK9 INHIBITION RA PHARMACEUTICALS, INC. (US) 2023-09-28 US disclosed
EP-2298901-B2 Novel herbicide resistance genes DOW AGROSCIENCES LLC (US) 2017-04-26 EP disclosed
US-20130109715-A1 6-Substituted isoquinolines and isoquinolinones SANOFI (FR) 2013-05-02 US disclosed
EP-2540163-A1 Nematocide N-cyclopropyl-sulfonylamide derivatives Bayer CropScience AG (DE) 2013-01-02 EP disclosed
US-7786122-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-08-31 US disclosed
US-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-04-10 US disclosed
EP-1697370-B1 AZABICYCLIC HETEROCYCLES AS CANNABINOID RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2007-04-25 EP 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 (3 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-20230303625-A1 CYCLIC POLYPEPTIDES FOR PCSK9 INHIBITION PCSK9, LDLR, PCSK7 TP53 3599/4885TAAR1 4470/4885KIF11 2988/4885
US-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS APP, APBA1, BACE1 TP53 1793/4885TAAR1 1355/4885KIF11 4847/4885
US-20130109715-A1 6-Substituted isoquinolines and isoquinolinones MYLK2, MYLK, MYLK3 TP53 1860/4885TAAR1 4584/4885KIF11 1492/4885

“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.