SCHEMBL13739335

SCHEMBL13739335

CCN1CC[C@H](C(=O)O)C1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.57
S1PR5 Q9H228 8/20 0.50
S1PR1 P21453 2/20 0.50
S1PR4 O95977 1/20 0.50
S1PR3 Q99500 1/20 0.50
NOTUM Q6P988 2/20 0.42
HSD11B1 P28845 1/20 0.42
CYP1A2 P05177 1/20 0.41
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL13740434 1.00 SMN1; SMN2 (0.57) SMN1; SMN2S1PR5S1PR1S1PR4S1PR3
SCHEMBL934458 1.00 SMN1; SMN2 (0.57) SMN1; SMN2S1PR5S1PR1S1PR4S1PR3
Hydrochloric Acid SCHEMBL28596153 0.98 SMN1; SMN2 (0.55) SMN1; SMN2S1PR5S1PR1S1PR4S1PR3
SCHEMBL1609328 0.88 SMN1; SMN2 (0.54) SMN1; SMN2S1PR5HSD11B1CYP1A2ALDH1A1
SCHEMBL771607 0.88 SMN1; SMN2 (0.54) SMN1; SMN2S1PR5HSD11B1CYP1A2ALDH1A1
SCHEMBL740141 0.88 SMN1; SMN2 (0.54) SMN1; SMN2S1PR5HSD11B1CYP1A2ALDH1A1
SCHEMBL855052 0.87 SMN1; SMN2 (0.67) SMN1; SMN2S1PR5S1PR1S1PR4S1PR3
Hydrochloric Acid SCHEMBL19638092 0.86 SMN1; SMN2 (0.56) SMN1; SMN2S1PR5ALDH1A1
Hydrochloric Acid SCHEMBL613075 0.86 SMN1; SMN2 (0.56) SMN1; SMN2S1PR5ALDH1A1
Hydrochloric Acid SCHEMBL6997154 0.85 SMN1; SMN2 (0.64) SMN1; SMN2S1PR5S1PR1S1PR4S1PR3

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023006019-A1 POLYSUBSTITUTED BENZENE PD-L1 INHIBITOR, COMPOSITION AND USE THEREOF 杭州和正医药有限公司 2023-02-02 WO disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
WO-2021121282-A1 PREPARATION AND APPLICATION OF CLASS OF N-CONTAINING HETEROCYCLIC COMPOUNDS WITH IMMUNOMODULATORY FUNCTION 上海轶诺药业有限公司 2021-06-24 WO disclosed
WO-2021093817-A1 IMMUNOMODULATORY COMPOUNDS, COMPOSITION AND APPLICATION THEREOF 杭州和正医药有限公司 2021-05-20 WO disclosed
WO-2020228649-A1 SUBSTITUTED PHENYLPROPENYLPYRIDINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 上海海雁医药科技有限公司 2020-11-19 WO disclosed
CN-104918615-B The method for treating hepatopathy 扎夫根股份有限公司 2018-10-12 CN disclosed
US-10064839-B2 Methods of treating liver diseases ZAFGEN, INC. (US) 2018-09-04 US disclosed
US-9868717-B2 Tricyclic sulphonamide compounds and methods of making and using same ZAFGEN, INC. (US) 2018-01-16 US disclosed
US-9868717-B2 Tricyclic sulphonamide compounds and methods of making and using same ZAFGEN, INC. (US) 2018-01-16 US disclosed
US-9868717-B2 Tricyclic sulphonamide compounds and methods of making and using same ZAFGEN, INC. (US) 2018-01-16 US disclosed
WO-2014071368-A1 METHODS OF TREATING LIVER DISEASES ZAFGEN, INC. (US) 2014-05-08 WO disclosed
CN-103764641-A Partially saturated tricyclic compounds and methods of making and using same ZAFGEN CORP 2014-04-30 CN disclosed
WO-2012154676-A9 PARTIALLY SATURATED TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN INC. (US) 2014-03-27 WO disclosed
US-20140088078-A1 Partially Saturated Tricyclic Compounds and Methods of Making and Using Same ZAFGEN, INC. (US) 2014-03-27 US disclosed
WO-2012154676-A9 PARTIALLY SATURATED TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN INC. (US) 2014-03-27 WO disclosed
US-20140088078-A1 Partially Saturated Tricyclic Compounds and Methods of Making and Using Same ZAFGEN, INC. (US) 2014-03-27 US disclosed
US-20140088078-A1 Partially Saturated Tricyclic Compounds and Methods of Making and Using Same ZAFGEN, INC. (US) 2014-03-27 US disclosed
EP-2705030-A1 PARTIALLY SATURATED TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN INC. (US) 2014-03-12 EP disclosed
WO-2012154676-A1 PARTIALLY SATURATED TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2012-11-15 WO disclosed
WO-2012154676-A1 PARTIALLY SATURATED TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2012-11-15 WO 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-10064839-B2 Methods of treating liver diseases ENPEP, GOT2, METAP2 SMN1; SMN2 4364/4885S1PR5 1622/4885S1PR1 1430/4885
US-20140088078-A1 Partially Saturated Tricyclic Compounds and Methods of Making and Using Same DNPEP, CES2, AADAC SMN1; SMN2 3316/4885S1PR5 2194/4885S1PR1 2590/4885

“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.