SCHEMBL2393325

SCHEMBL2393325

CC[C@@]1(C(=O)O)C[C@@H]1c1ccc(F)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 12/20 0.42
RCOR1 Q9UKL0 3/20 0.42
CCR2 P41597 1/20 0.36
PRKAG1 P54619 1/20 0.35
PRKAA1 Q13131 1/20 0.35
PRKAB1 Q9Y478 1/20 0.35
GPR88 Q9GZN0 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL7077980 0.80 KDM1A (0.51) KDM1ARCOR1TSHR
SCHEMBL556983 0.79 ADAMTS5 (0.37) KDM1AALDH1A1
SCHEMBL533997 0.79 ADAMTS5 (0.37) KDM1AALDH1A1
SCHEMBL15767640 0.78 KDM1A (0.51) KDM1A
SCHEMBL11700667 0.78 KDM1A (0.51) KDM1A
SCHEMBL1943935 0.78 KDM1A (0.51) KDM1A
SCHEMBL3739337 0.77 KDM1A (0.40) KDM1ARCOR1
SCHEMBL1000359 0.77 KDM1A (0.51) KDM1ARCOR1TSHRALDH1A1
SCHEMBL15766918 0.77 KDM1A (0.51) KDM1ARCOR1TSHRALDH1A1
SCHEMBL15766917 0.77 KDM1A (0.51) KDM1ARCOR1TSHRALDH1A1

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-8026396-B2 Processes for the preparation of optically active intermediates ASTRAZENECA AB (SE) 2011-09-27 US disclosed
US-7790927-B2 Using hypochlorite in water in presence of alkali metal hydroxide ASTRAZENECA AB (SE) 2010-09-07 US disclosed
US-20080071114-A1 Processes For The Preparation Of Optically Active Intermediates ASTRAZENECA AB (SE) 2008-03-20 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-20080071114-A1 Processes For The Preparation Of Optically Active Intermediates DHPS, CYP1B1, CYP2S1 KDM1A 2949/4885RCOR1 4694/4885CCR2 2676/4885

“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.