SCHEMBL22160661

SCHEMBL22160661

NC(=O)C1CNC[C@@H]1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
CYP2D6 P10635 1/20 0.41
NOS2 P35228 1/20 0.39
EPHX1 P07099 1/20 0.39
MAN1B1 Q9UKM7 1/20 0.35
SLC6A2 P23975 2/20 0.34
SLC6A4 P31645 2/20 0.34
MC4R P32245 1/20 0.33
CHRNB2 P17787 2/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32
CHRNA4 P43681 2/20 0.32
CHRNA7 P36544 1/20 0.32
FUCA1 P04066 2/20 0.32
GBA1 P04062 2/20 0.32
GLA P06280 2/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL22160660 1.00 KDM4E (0.41) KDM4EMAPTKMT2AATMCYP2D6
SCHEMBL22160677 1.00 KDM4E (0.41) KDM4EMAPTKMT2AATMCYP2D6
SCHEMBL22160703 1.00 KDM4E (0.41) KDM4EMAPTKMT2AATMCYP2D6
SCHEMBL1054289 1.00 KDM4E (0.41) KDM4EMAPTKMT2AATMCYP2D6
Hydrochloric Acid SCHEMBL22160668 0.97 KDM4E (0.39) KDM4EMAPTKMT2AATMCYP2D6
SCHEMBL24073107 0.87 EPHX1 (0.37) KDM4EMAPTKMT2AATMCYP2D6
SCHEMBL15193822 0.84
SCHEMBL17340414 0.84
SCHEMBL2722506 0.84
SCHEMBL23951568 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11040959-B2 Diprovocims: a new and potent class of TLR agonists THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-06-22 US disclosed
EP-3445758-B1 DIPROVOCIMS: A NEW AND POTENT CLASS OF TLR AGONISTS SCRIPPS RESEARCH INST (US) 2020-11-04 EP disclosed
US-20200207742-A1 DIPROVOCIMS: A NEW AND POTENT CLASS OF TLR AGONISTS THE SCRIPPS RESEARCH INSTITUTE 2020-07-02 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-20200207742-A1 DIPROVOCIMS: A NEW AND POTENT CLASS OF TLR AGONISTS TLR1, TLR4, TLR2 KDM4E 1177/4885MAPT 4333/4885KMT2A 1161/4885
US-11040959-B2 Diprovocims: a new and potent class of TLR agonists TLR1, TLR4, TLR2 KDM4E 1160/4885MAPT 4381/4885KMT2A 1052/4885

“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.