SCHEMBL3752153

SCHEMBL3752153

CCOC(=O)C(C)C1CC2(CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.50
GAA P10253 2/20 0.46
APP P05067 3/20 0.45
ALDH1A1 P00352 7/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
KDM4E B2RXH2 1/20 0.44
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
HSD11B1 P28845 1/20 0.41
HTT P42858 4/20 0.41
LMNA P02545 2/20 0.41
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL3742443 0.92 KMT2A (0.43) POLBALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL3744641 0.88 HSD11B1 (0.47) POLBGAAALDH1A1SMN1; SMN2MEN1
SCHEMBL3750678 0.85 ALDH1A1 (0.44) APPALDH1A1KDM4EMEN1KMT2A
SCHEMBL3747454 0.82 POLB (0.48) POLBGAAAPPALDH1A1SMN1; SMN2
SCHEMBL3749402 0.79 CYP2D6 (0.43) GAAALDH1A1SMN1; SMN2KMT2AHSD11B1
SCHEMBL3742454 0.77 HSD11B1 (0.44) POLBGAAALDH1A1SMN1; SMN2KDM4E
SCHEMBL3751027 0.77 OPRM1 (0.43) ALDH1A1HTTMAPT
SCHEMBL3744810 0.77 HSD11B1 (0.54) POLBGAAALDH1A1SMN1; SMN2MEN1
SCHEMBL3744663 0.75 HSD11B1 (0.48) POLBGAAALDH1A1SMN1; SMN2MEN1
SCHEMBL3752150 0.74 POLB (0.50) POLBGAAAPPALDH1A1SMN1; SMN2

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-20100298368-A1 ANTAGONISTS OF PGD2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-11-25 US disclosed
WO-2009061681-A2 ANTAGONISTS OF PGD2 RECEPTORS AMIRA PHARMACEUTICALS, INC (US) 2009-05-14 WO 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-20100298368-A1 ANTAGONISTS OF PGD2 RECEPTORS PTGDR2, PTGDR, LTB4R2 POLB 4394/4885GAA 4174/4885APP 4025/4885

“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.