SCHEMBL17445693

SCHEMBL17445693

CC(C)(C)C(=O)CC1CCOC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LIPA P38571 1/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
PARP1 P09874 1/20 0.32
NSD2 O96028 1/20 0.32
NAMPT P43490 3/20 0.32
RIPK1 Q13546 1/20 0.31
PDE4D Q08499 1/20 0.30

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
SCHEMBL20286470 0.91 PDE4A (0.33) LIPACNR1CNR2NAMPTPDE4D
SCHEMBL13727465 0.88 LIPA (0.42) LIPACNR1CNR2RIPK1
SCHEMBL17445699 0.85 LIPA (0.35) LIPA
SCHEMBL19881202 0.81 CNR1 (0.30) LIPACNR1CNR2
SCHEMBL13616894 0.79
SCHEMBL16790679 0.79
SCHEMBL8406312 0.78 LIPA (0.52) LIPANAMPT
SCHEMBL628315 0.77
SCHEMBL1691652 0.77
SCHEMBL628314 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11802105-B2 Treprostinil derivatives and compositions and uses thereof Corsair Pharma, Inc. (US) 2023-10-31 US disclosed
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BEONE MEDICINES I GMBH (CH) 2023-07-13 US disclosed
US-20230030115-A1 RHO-ASSOCIATED PROTEIN KINASE INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD AND USE THEREOF BEIJING TIDE PHARMACEUTICAL CO LTD (CN) 2023-02-02 US disclosed
US-20220378743-A1 METHOD FOR TREATING FATTY LIVER DISEASE AND/OR STEATOHEPATITIS BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) 2022-12-01 US disclosed
US-11130749-B2 2021-09-28 US disclosed
US-10988435-B2 Treprostinil derivatives and compositions and uses thereof Corsair Pharma, Inc. (US) 2021-04-27 US disclosed
US-20200347006-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF Corsair Pharma, Inc. (US) 2020-11-05 US disclosed
US-10703706-B2 Treprostinil derivatives and compositions and uses thereof Corsair Pharma, Inc. (US) 2020-07-07 US disclosed
US-20190276440-A1 RHO-ASSOCIATED PROTEIN KINASE INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD AND USE THEREOF BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) 2019-09-12 US disclosed
US-20190241499-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF CORSAIR PHARMA INC (US) 2019-08-08 US disclosed
US-10202345-B2 Substituted azaspiro(4.5)decane derivatives GRUENENTHAL GMBH (DE) 2019-02-12 US disclosed
US-20180170855-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF Corsair Pharma, Inc. 2018-06-21 US disclosed
US-20180170855-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF Corsair Pharma, Inc. 2018-06-21 US disclosed
US-20160016903-A1 Substituted Azaspiro(4.5)Decane Derivatives GRUENENTHAL GMBH (DE) 2016-01-21 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 (13 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-10202345-B2 Substituted azaspiro(4.5)decane derivatives OPRL1, OPRD1, OPRM1 LIPA 2393/4885CNR1 37/4885CNR2 70/4885
US-20200347006-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF PTGIS, PTGIR, PDE3A LIPA 1403/4885CNR1 2407/4885CNR2 1902/4885
US-20190241499-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF PTGIS, PTGIR, PDE3A LIPA 1403/4885CNR1 2407/4885CNR2 1902/4885
US-10988435-B2 Treprostinil derivatives and compositions and uses thereof PTGIS, PTGIR, PDE3A LIPA 1403/4885CNR1 2407/4885CNR2 1902/4885
US-10703706-B2 Treprostinil derivatives and compositions and uses thereof PTGIS, PTGIR, PDE3A LIPA 1403/4885CNR1 2407/4885CNR2 1902/4885
US-20230219975-A1 PYRIDO[2,3-B][1,4]OXAZINES OR TETRAHYDROPYRIDO[2,3-B][1,4]OXAZEPINES AS IAP ANTAGONISTS BIRC2, BIRC3, API5 LIPA 4831/4885CNR1 1957/4885CNR2 2424/4885
US-11802105-B2 Treprostinil derivatives and compositions and uses thereof PTGIS, PTGIR, PDE3A LIPA 1403/4885CNR1 2407/4885CNR2 1902/4885
US-20180170855-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF PTGIS, PTGIR, PDE3A LIPA 1403/4885CNR1 2407/4885CNR2 1902/4885
US-20230030115-A1 RHO-ASSOCIATED PROTEIN KINASE INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD AND USE THEREOF ROCK1, ROCK2, RHOA LIPA 1362/4885CNR1 4082/4885CNR2 3964/4885
US-11130749-B2 ROCK1, RHOA, ROCK2 LIPA 929/4885CNR1 3908/4885CNR2 3993/4885
US-20160016903-A1 Substituted Azaspiro(4.5)Decane Derivatives OPRL1, OPRD1, OPRM1 LIPA 2393/4885CNR1 37/4885CNR2 70/4885
US-20190276440-A1 RHO-ASSOCIATED PROTEIN KINASE INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD AND USE THEREOF ROCK1, ROCK2, RHOA LIPA 1362/4885CNR1 4082/4885CNR2 3964/4885
US-20220378743-A1 METHOD FOR TREATING FATTY LIVER DISEASE AND/OR STEATOHEPATITIS SLC10A1, CYP7A1, FABP1 LIPA 65/4885CNR1 1048/4885CNR2 1129/4885

“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.