SCHEMBL22070546

SCHEMBL22070546

COc1ccc(COc2cc(CCCO)ccc2F)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.48
EPHX2 P34913 1/20 0.48
APP P05067 4/20 0.46
FFAR1 O14842 2/20 0.46
CALM1 P0DP23 2/20 0.45
ABCB1 P08183 2/20 0.45
IGF1R P08069 1/20 0.44
ALOX15 P16050 1/20 0.44
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
PTGES O14684 1/20 0.44
ALOX5 P09917 1/20 0.44
TNKS2 Q9H2K2 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
SCHEMBL22070810 0.87 LTA4H (0.46) LTA4HEPHX2APPFFAR1CALM1
SCHEMBL20201940 0.86 CYP4F2 (0.51) APPFFAR1ABCB1
SCHEMBL4159177 0.82 TNKS2 (0.56) TNKS2
SCHEMBL29886710 0.79 LTA4H (0.73) LTA4HEPHX2APPFFAR1CALM1
SCHEMBL20231446 0.78 TNKS2 (0.50) TNKS2
SCHEMBL22070863 0.78 CYP4F2 (0.61) LTA4HEPHX2APPFFAR1ABCB1
SCHEMBL22070576 0.78 FFAR1 (0.48) APPFFAR1
SCHEMBL25385463 0.77 LTA4H (0.41) LTA4HEPHX2CALM1ABCB1IGF1R
SCHEMBL30574944 0.77 LTA4H (0.41) LTA4HEPHX2CALM1ABCB1IGF1R
SCHEMBL79113 0.75 CALM1 (0.68) LTA4HEPHX2CALM1IGF1RALOX15

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-11365192-B2 Pyridine compound substituted with azole TAISHO PHARMACEUTICAL CO., LTD. (JP) 2022-06-21 US disclosed
US-11365192-B2 Pyridine compound substituted with azole TAISHO PHARMACEUTICAL CO., LTD. (JP) 2022-06-21 US disclosed
US-20210122741-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE TAISHO PHARMACEUTICAL CO., LTD (JP) 2021-04-29 US disclosed
US-20210122741-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE TAISHO PHARMACEUTICAL CO., LTD (JP) 2021-04-29 US disclosed
EP-3666766-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE Taisho Pharmaceutical Co., Ltd. (JP) 2020-06-17 EP disclosed
EP-3666766-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE Taisho Pharmaceutical Co., Ltd. (JP) 2020-06-17 EP disclosed
CN-110914254-A Azole-substituted pyridine compound 大正制药株式会社 2020-03-24 CN 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-20210122741-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE CYP2C19, CYP4A11, CYP11B1 LTA4H 81/4885EPHX2 295/4885APP 3612/4885
US-11365192-B2 Pyridine compound substituted with azole CYP2C19, CYP4A11, CYP11B1 LTA4H 81/4885EPHX2 295/4885APP 3612/4885

“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.