SCHEMBL10149357

SCHEMBL10149357

COC(=O)[C@@H](C)C1CCC(O)CC1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.40
▸ SHBG P04278 1/20 0.39
▸ CA14 Q9ULX7 3/20 0.38
▸ THRB P10828 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ MMP2 P08253 1/20 0.34
▸ MMP3 P08254 1/20 0.34
▸ MMP13 P45452 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CA12 O43570 2/20 0.32
▸ ALOX5 P09917 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL12534071 0.91 — —
SCHEMBL13616798 0.91 — —
SCHEMBL4953927 0.83 POLB (0.41) CA14THRBSMN1; SMN2TSHRTP53
SCHEMBL12290766 0.83 THRB (0.46) EPHX2CA14THRBSMN1; SMN2MMP2
SCHEMBL15776933 0.83 THRB (0.46) CA14THRBSMN1; SMN2MMP2TSHR
SCHEMBL11443344 0.83 THRB (0.46) EPHX2CA14THRBSMN1; SMN2MMP2
SCHEMBL13209988 0.82 DPP4 (0.41) EPHX2SHBGCA14THRBSMN1; SMN2
SCHEMBL21579732 0.82 DPP4 (0.41) EPHX2SHBGCA14THRBSMN1; SMN2
SCHEMBL18504893 0.82 THRB (0.39) EPHX2CA14THRBSMN1; SMN2TSHR
SCHEMBL1874858 0.81 TP53 (0.47) EPHX2THRBSMN1; SMN2MMP2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357254-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 JANSSEN PHARMACEUTICA NV (BE) 2023-11-09 — — US disclosed
US-11702422-B2 Imidazopyridazines as modulators of IL-17 JANSSEN PHARMACEUTICA NV (BE) 2023-07-18 — — US disclosed
US-11691979-B2 Imidazopyridazines as modulators of IL-17 JANSSEN PHARMACEUTICA NV (BE) 2023-07-04 — — US disclosed
US-9040706-B2 Pyrrolidine inhibitors of IAP GENENTECH, INC. (US) 2015-05-26 — — US disclosed
US-8980837-B2 Inhibitors of IAP GENENTECH, INC. (US) 2015-03-17 — — US disclosed
US-8907092-B2 Inhibitors of IAP GENENTECH, INC. (US) 2014-12-09 — — US disclosed
US-8835393-B2 Inhibitors of IAP GENENTECH, INC. (US) 2014-09-16 — — US disclosed
US-20140080805-A1 PYRROLIDINE INHIBITORS OF IAP GENENTECH, INC. (US) 2014-03-20 — — US disclosed
US-20120270886-A1 INHIBITORS OF IAP KOEHLER MICHAEL F T (US) 2012-10-25 — — US disclosed
US-20120202750-A1 INHIBITORS OF IAP GENENTECH, INC. (US) 2012-08-09 — — US disclosed
US-20120015974-A1 IMIDAZOPYRIDINE INHIBITORS OF IAP GENENTECH, INC. (US) 2012-01-19 — — US disclosed
US-20110269696-A1 INHIBITORS OF IAPS GENENTECH INC. (US) 2011-11-03 — — US disclosed
US-20110218211-A1 AZAINDOLE INHIBITORS OF IAP GENENTECH, INC. (US) 2011-09-08 — — US disclosed
US-20110077265-A1 INHIBITORS OF IAP GENENTECH, INC. (US) 2011-03-31 — — US disclosed
US-20110046066-A1 INHIBITORS OF IAP GENENTECH, INC. (US) 2011-02-24 — — 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 (11 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-11691979-B2 Imidazopyridazines as modulators of IL-17 IL17A, IL23R, IL15 EPHX2 3366/4885SHBG 2074/4885CA14 4359/4885
US-20230357254-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 IL17A, IL23R, IL15 EPHX2 3366/4885SHBG 2074/4885CA14 4359/4885
US-20110269696-A1 INHIBITORS OF IAPS XIAP, BIRC5, BIRC3 EPHX2 3408/4885SHBG 4627/4885CA14 3584/4885
US-20110046066-A1 INHIBITORS OF IAP BIRC5, XIAP, BIRC3 EPHX2 3303/4885SHBG 4355/4885CA14 3731/4885
US-20120202750-A1 INHIBITORS OF IAP XIAP, BIRC5, BIRC3 EPHX2 4157/4885SHBG 4538/4885CA14 4320/4885
US-11702422-B2 Imidazopyridazines as modulators of IL-17 IL17A, IL23R, IL15 EPHX2 3366/4885SHBG 2074/4885CA14 4359/4885
US-20120270886-A1 INHIBITORS OF IAP XIAP, BIRC5, BIRC3 EPHX2 3740/4885SHBG 4680/4885CA14 3245/4885
US-20120015974-A1 IMIDAZOPYRIDINE INHIBITORS OF IAP BIRC5, XIAP, BIRC3 EPHX2 4055/4885SHBG 4768/4885CA14 4172/4885
US-20110218211-A1 AZAINDOLE INHIBITORS OF IAP XIAP, BIRC5, API5 EPHX2 3860/4885SHBG 4806/4885CA14 3214/4885
US-20140080805-A1 PYRROLIDINE INHIBITORS OF IAP BIRC5, XIAP, BIRC2 EPHX2 4205/4885SHBG 4674/4885CA14 4397/4885
US-20110077265-A1 INHIBITORS OF IAP XIAP, BIRC5, BIRC2 EPHX2 3589/4885SHBG 4126/4885CA14 4396/4885

“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.

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