SCHEMBL6607847

SCHEMBL6607847

COc1ccc([C@]2(C#N)CC[C@@H](C(=O)O)CC2)c2c1OCCO2

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 15/20 0.53
PDE4A P27815 14/20 0.53
PDE4C Q08493 14/20 0.53
PDE4D Q08499 14/20 0.53
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL6607854 1.00 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL29357646 1.00 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL4958570 1.00 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL4957740 0.96 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL7654261 0.96 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL7654256 0.96 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL7659290 0.93 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL7659295 0.93 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL7659299 0.93 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL6602217 0.90 KDM4E (0.42) PDE4BPDE4APDE4CPDE4DLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230009902-A1 TREATMENT OF A DISEASE OR CONDITION IN A TISSUE ORGINATING FROM THE ENDODERM GLAS USA LLC 2023-01-12 US disclosed
US-20210031012-A1 TREATMENT OF A DISEASE OF THE GASTROINTESTINAL TRACT WITH A PDE4 INHIBITOR GLAS USA LLC 2021-02-04 US disclosed
US-20200323772-A1 TREATMENT OF INFLAMMATORY DISEASE USING INGESTIBLE DEVICE TO RELEASE IMMUNE MODULATOR BT BIDCO LLC 2020-10-15 US disclosed
WO-2019246317-A9 TREATMENT OF A DISEASE OR CONDITION IN A TISSUE ORIGINATING FROM THE ENDODERM PROGENITY, INC. (US) 2020-07-16 WO disclosed
WO-2019147824-A1 TREATMENT OF A DISEASE OF THE GASTROINTESTINAL TRACT WITH A PDE4 INHIBITOR PROGENITY, INC. (US) 2019-08-01 WO disclosed
WO-2019036382-A1 TREATMENT OF INFLAMMATORY DISEASE USING INGESTIBLE DEVICE TO RELEASE IMMUNE MODULATOR PROGENITY INC. (US) 2019-02-21 WO disclosed
US-20080085858-A1 Pharmaceutical Composition KYOWA HAKKO KOGYO CO., LTD. (JP) 2008-04-10 US disclosed
US-20080085858-A1 Pharmaceutical Composition KYOWA HAKKO KOGYO CO., LTD. (JP) 2008-04-10 US disclosed
US-20070287689-A1 Therapeutic And/Or Preventive Agents For Chronic Skin Diseases KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-12-13 US disclosed
US-20070287689-A1 Therapeutic And/Or Preventive Agents For Chronic Skin Diseases KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-12-13 US disclosed
EP-1813284-A1 PHARMACEUTICAL COMPOSITION KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-08-01 EP disclosed
EP-1810692-A1 REMEDIES/PREVENTIVES FOR CHRONIC SKIN DISEASE KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-25 EP disclosed
EP-1110961-B1 OXYGENIC HETEROCYCLIC COMPOUNDS KYOWA HAKKO KOGYO KK (JP) 2004-07-14 EP disclosed
US-20040054197-A1 Styrene derivatives and process for production thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-03-18 US disclosed
EP-1362853-A1 STYRENE DERIVATIVES AND PROCESS FOR PRODUCTION THEREOF Kyowa Hakko Kogyo Co., Ltd (JP) 2003-11-19 EP disclosed
US-6376535-B2 PHOSPHODIESTERASE (PDE) INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-04-23 US disclosed
US-20010056117-A1 Oxygen-containing heterocyclic compounds KYOWA HAKKO KIRIN CO., LTD. (JP) 2001-12-27 US disclosed
EP-1110961-A1 OXYGENIC HETEROCYCLIC COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-06-27 EP disclosed
JP-2000319166-A ENTERIC PREPARATION KYOWA HAKKO KOGYO CO LTD 2000-11-21 JP 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 (7 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-20210031012-A1 TREATMENT OF A DISEASE OF THE GASTROINTESTINAL TRACT WITH A PDE4 INHIBITOR PDE4A, PDE12, PDE4B PDE4B 3/4885PDE4A 1/4885PDE4C 4/4885
US-20010056117-A1 Oxygen-containing heterocyclic compounds CBR1, CBR3, MT-CO1 PDE4B 2596/4885PDE4A 2844/4885PDE4C 3154/4885
US-20080085858-A1 Pharmaceutical Composition PDE3B, PDE3A, PDE5A PDE4B 5/4885PDE4A 4/4885PDE4C 6/4885
US-20040054197-A1 Styrene derivatives and process for production thereof HSD3B1, SULT1A1, HSD3B2 PDE4B 4492/4885PDE4A 4611/4885PDE4C 4823/4885
US-20230009902-A1 TREATMENT OF A DISEASE OR CONDITION IN A TISSUE ORGINATING FROM THE ENDODERM ALPG, ALPP, FABP2 PDE4B 1544/4885PDE4A 1695/4885PDE4C 1968/4885
US-20200323772-A1 TREATMENT OF INFLAMMATORY DISEASE USING INGESTIBLE DEVICE TO RELEASE IMMUNE MODULATOR LRBA, CD47, FABP2 PDE4B 611/4885PDE4A 559/4885PDE4C 874/4885
US-20070287689-A1 Therapeutic And/Or Preventive Agents For Chronic Skin Diseases PDE4A, PDE3B, PDE2A PDE4B 7/4885PDE4A 1/4885PDE4C 6/4885

“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.