SCHEMBL24017669

SCHEMBL24017669

C[C@@H](O)c1ccc(F)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.37
HTR1B P28222 1/20 0.37
HTR2B P41595 1/20 0.37
GPR65 Q8IYL9 1/20 0.37
F2RL1 P55085 1/20 0.36
PDE2A O00408 2/20 0.34
CXCR5 P32302 1/20 0.33
KCNH2 Q12809 3/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A3 Q01959 3/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
CYP3A4 P08684 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MPI P34949 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 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
SCHEMBL19667840 0.87 GABRA1 (0.39) HTR2BPDE2AHTR2CCYP3A4KDM4E
SCHEMBL12463310 0.83 HTR2B (0.42) SIGMAR1HTR1BHTR2BGPR65SLC6A4
SCHEMBL25688660 0.79 HTR1B (0.37) SIGMAR1HTR1BHTR2BGPR65F2RL1
SCHEMBL1253164 0.79 PDE2A (0.43) SIGMAR1HTR1BHTR2BGPR65PDE2A
SCHEMBL27467123 0.79 HTR1B (0.37) SIGMAR1HTR1BHTR2BGPR65F2RL1
SCHEMBL7003988 0.79 PDE2A (0.43) SIGMAR1HTR1BHTR2BGPR65PDE2A
SCHEMBL27833885 0.79 CNR1 (0.38) HTR1BHTR2BGPR65CXCR5HTR2C
SCHEMBL14065417 0.78 CES2 (0.37) SIGMAR1HTR1BHTR2BGPR65F2RL1
Hydrochloric Acid SCHEMBL2149832 0.78 PDE2A (0.42) SIGMAR1HTR1BHTR2BGPR65PDE2A
SCHEMBL19667842 0.77 CYP1A2 (0.46) HTR2BHTR2CCYP3A4KDM4E

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-11174282-B2 Aminosteroid derivatives and process for producing same UNIVERSITé LAVAL (CA) 2021-11-16 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-11174282-B2 Aminosteroid derivatives and process for producing same HSD17B11, HSD17B7, CYP19A1 SIGMAR1 1322/4885HTR1B 1715/4885HTR2B 1874/4885

“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.