SCHEMBL19502428

SCHEMBL19502428

CC(C)OC(=O)[C@H]1CCCN1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.41
DPP7 Q9UHL4 1/20 0.40
NOS2 P35228 2/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
TLR2 O60603 2/20 0.38
DPP4 P27487 2/20 0.38
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
SCN4A P35499 1/20 0.36
IDO1 P14902 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL84845 1.00 PRCP (0.41) PRCPDPP7NOS2NOS3NOS1
SCHEMBL7782161 1.00 PRCP (0.41) PRCPDPP7NOS2NOS3NOS1
Hydrochloric Acid SCHEMBL29401738 0.98 PRCP (0.41) PRCPDPP7NOS2NOS3NOS1
Hydrochloric Acid SCHEMBL16007350 0.98 PRCP (0.41) PRCPDPP7NOS2NOS3NOS1
Hydrochloric Acid SCHEMBL16007352 0.98 PRCP (0.41) PRCPDPP7NOS2NOS3NOS1
SCHEMBL5538288 0.94 TSHR (0.40) PRCPDPP7CYP3A4CYP2D6CYP1A2
SCHEMBL7886550 0.94 TSHR (0.40) PRCPDPP7CYP3A4CYP2D6CYP1A2
Hydrochloric Acid SCHEMBL7886551 0.93 TSHR (0.40) PRCPCYP3A4CYP2D6CYP2C9TSHR
SCHEMBL31008706 0.90 TSHR (0.37) PRCPNOS2NOS3NOS1TSHR
SCHEMBL15391851 0.89 PRCP (0.41) PRCPDPP7NOS2NOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10035791-B2 Bicyclic compound and pharmaceutical composition thereof for treating stroke and use thereof CHINA MEDICAL UNIVERSITY (TW) 2018-07-31 US disclosed
US-20170298049-A1 BICYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF FOR TREATING STROKE AND USE THEREOF CHINA MEDICAL UNIVERSITY (TW) 2017-10-19 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 (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-20170298049-A1 BICYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF FOR TREATING STROKE AND USE THEREOF PCSK9, NDUFC2, PCSK7 PRCP 719/4885DPP7 1134/4885NOS2 2011/4885
US-10035791-B2 Bicyclic compound and pharmaceutical composition thereof for treating stroke and use thereof PCSK9, NDUFC2, PCSK7 PRCP 719/4885DPP7 1134/4885NOS2 2011/4885

“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.