SCHEMBL21177162

SCHEMBL21177162

Fc1[c]c(CCN2CCOCC2)ccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.49
POLB P06746 1/20 0.49
KDM4E B2RXH2 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
CYP2A13 Q16696 3/20 0.41
CNR1 P21554 2/20 0.41
ACHE P22303 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ATM Q13315 1/20 0.40
CXCR4 P61073 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 1/20 0.40
LMNA P02545 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL28449946 0.91 SIGMAR1 (0.54) SIGMAR1POLBKDM4EKMT2AALDH1A1
SCHEMBL21177124 0.85 CYP2A13 (0.50) KDM4EKMT2AMEN1CYP2A13ALDH1A1
SCHEMBL1741859 0.73 SIGMAR1 (0.56) SIGMAR1POLBKMT2AMEN1CNR1
SCHEMBL932843 0.71 ACHE (0.48) SIGMAR1POLBKDM4EKMT2AACHE
SCHEMBL949897 0.71 SIGMAR1 (0.49) SIGMAR1POLBKMT2AMEN1CYP2A13
SCHEMBL3184921 0.70 SIGMAR1 (0.45) SIGMAR1POLBKDM4EKMT2AMEN1
SCHEMBL21177081 0.70 KDM4E (0.39) KDM4EKMT2AMEN1CYP2A13CXCR4
SCHEMBL21177104 0.69 ALDH1A1 (0.46) POLBKDM4EALDH1A1L3MBTL1HTT
SCHEMBL21177075 0.69 LMNA (0.42) POLBKDM4EKMT2AMEN1CYP2A13
SCHEMBL21177108 0.69 MC4R (0.47) SIGMAR1POLBKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11739070-B2 C5A receptor modulators IDORSIA PHARMACEUTICALS LTD. (CH) 2023-08-29 US disclosed
EP-3740476-A1 C5A RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2020-11-25 EP disclosed
US-20200347029-A1 C5A RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD. (CH) 2020-11-05 US disclosed
CN-111615513-A C5a receptor modulators 爱杜西亚药品有限公司 2020-09-01 CN disclosed
WO-2019141803-A1 C5A RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2019-07-25 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 (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-20200347029-A1 C5A RECEPTOR MODULATORS C5AR1, C3AR1, C5AR2 SIGMAR1 384/4885POLB 4790/4885KDM4E 2797/4885
US-11739070-B2 C5A receptor modulators C5AR1, C3AR1, C5AR2 SIGMAR1 384/4885POLB 4790/4885KDM4E 2797/4885

“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.