SCHEMBL12425634

SCHEMBL12425634

CCCC(=O)N1CCC(CO)CC1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 8/20 0.51
GNAO1 P09471 8/20 0.51
GNAI1 P63096 8/20 0.51
EPHX1 P07099 2/20 0.49
EPHX2 P34913 2/20 0.49
NPC1 O15118 1/20 0.48
CHRNB2 P17787 1/20 0.46
CHRNA3 P32297 1/20 0.46
CHRNA4 P43681 1/20 0.46
CHRNB3 Q05901 1/20 0.46
CHRNA6 Q15825 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
ITGB3 P05106 2/20 0.43
ITGA2B P08514 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HSD11B1 P28845 1/20 0.42

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
SCHEMBL30484014 0.89 CHRNB2 (0.47) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL11892760 0.89 CHRNB2 (0.47) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL11892691 0.89 CHRNB2 (0.47) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL13097131 0.87 GNAI3 (0.67) GNAI3GNAO1GNAI1NPC1L3MBTL1
SCHEMBL18330354 0.86 GNAI3 (0.51) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL10274497 0.85 GNAI3 (0.58) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL621450 0.84 EPHX2 (0.50) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL6029860 0.83 GNAI3 (0.49) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL3317741 0.83 GNAI3 (0.49) GNAI3GNAO1GNAI1EPHX1EPHX2
SCHEMBL14146925 0.83 GNAI3 (0.50) GNAI3GNAO1GNAI1EPHX1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240308989-A1 PYRAN DERIVATIVES AS CYP11A1 (CYTOCHROME P450 MONOOXYGENASE 11A1) INHIBITORS ORION CORP (FI) 2024-09-19 US disclosed
US-12030871-B2 Pyran dervatives as CYP11A1 (cytochrome P450 monooxygenase 11A1) inhibitors ORION CORPORATION (FI) 2024-07-09 US disclosed
US-20210347765-A1 PYRAN DERVATIVES AS CYP11A1 (CYTOCHROME P450 MONOOXYGENASE 11A1) INHIBITORS ORION CORPORATION 2021-11-11 US disclosed
EP-3558981-B1 PYRAN DERIVATIVES AS CYP11A1 (CYTOCHROME P450 MONOOXYGENASE 11A1) INHIBITORS ORION CORP (FI) 2021-05-26 EP disclosed
US-20200299280-A1 PYRAN DERVATIVES AS CYP11A1 (CYTOCHROME P450 MONOOXYGENASE 11A1) INHIBITORS ORION CORP (FI) 2020-09-24 US disclosed
US-10717726-B2 Pyran dervatives as CYP11A1 (cytochrome P450 monooxygenase 11A1) inhibitors ORION CORPORATION (FI) 2020-07-21 US disclosed
US-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2011-08-18 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 (6 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-10717726-B2 Pyran dervatives as CYP11A1 (cytochrome P450 monooxygenase 11A1) inhibitors CYP11B1, CYP11B2, CYP4A11 GNAI3 1871/4885GNAO1 936/4885GNAI1 1620/4885
US-20210347765-A1 PYRAN DERVATIVES AS CYP11A1 (CYTOCHROME P450 MONOOXYGENASE 11A1) INHIBITORS CYP11B1, CYP11B2, CYP4A11 GNAI3 1871/4885GNAO1 936/4885GNAI1 1620/4885
US-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF CCNY, CCNA1, CCNA2 GNAI3 3226/4885GNAO1 2674/4885GNAI1 2658/4885
US-12030871-B2 Pyran dervatives as CYP11A1 (cytochrome P450 monooxygenase 11A1) inhibitors CYP11B1, CYP11B2, CYP4A11 GNAI3 1871/4885GNAO1 936/4885GNAI1 1620/4885
US-20240308989-A1 PYRAN DERIVATIVES AS CYP11A1 (CYTOCHROME P450 MONOOXYGENASE 11A1) INHIBITORS CYP11B1, CYP11B2, CYP4A11 GNAI3 1682/4885GNAO1 767/4885GNAI1 1538/4885
US-20200299280-A1 PYRAN DERVATIVES AS CYP11A1 (CYTOCHROME P450 MONOOXYGENASE 11A1) INHIBITORS CYP11B1, CYP11B2, CYP4A11 GNAI3 1871/4885GNAO1 936/4885GNAI1 1620/4885

“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.