SCHEMBL24229259

SCHEMBL24229259

CC(C)(C)CC(O)COC(=O)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.34
ADRB2 P07550 5/20 0.33
ADRB1 P08588 5/20 0.33
ADRB3 P13945 5/20 0.33
HTT P42858 1/20 0.32

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
SCHEMBL24229139 0.82 HTT (0.35) PRKCAADRB2ADRB1ADRB3HTT
SCHEMBL18133306 0.79 PRKCA (0.33) PRKCAHTT
SCHEMBL24229265 0.79 MEN1 (0.36)
SCHEMBL20225119 0.78 LMNA (0.42) PRKCAHTT
SCHEMBL28573463 0.78 ALDH1A1 (0.40) ADRB2ADRB1ADRB3
SCHEMBL24229255 0.77 LMNA (0.35) PRKCAHTT
SCHEMBL24229253 0.77 HTT (0.32) PRKCAADRB2ADRB1ADRB3HTT
SCHEMBL22980099 0.76 LMNA (0.44) ADRB2ADRB1ADRB3HTT
SCHEMBL1487052 0.76 LMNA (0.44) ADRB2ADRB1ADRB3HTT
SCHEMBL1487054 0.76 LMNA (0.44) ADRB2ADRB1ADRB3HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220106262-A1 PREPARATION OF CATIONIC SURFACTANTS SAUDI ARABIAN OIL COMPANY (SA) 2022-04-07 US disclosed
WO-2022026657-A1 PREPARATION OF CATIONIC SURFACTANTS SAUDI ARABIAN OIL COMPANY (SA) 2022-02-03 WO disclosed
US-20220033348-A1 PREPARATION OF CATIONIC SURFACTANTS SAUDI ARABIAN OIL COMPANY (SA) 2022-02-03 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-20220033348-A1 PREPARATION OF CATIONIC SURFACTANTS HDHD5, FAAH, ELOVL5 PRKCA 2424/4885ADRB2 1392/4885ADRB1 1168/4885
US-20220106262-A1 PREPARATION OF CATIONIC SURFACTANTS HDHD5, FAAH, ELOVL5 PRKCA 2424/4885ADRB2 1392/4885ADRB1 1168/4885

“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.