SCHEMBL25564438

SCHEMBL25564438

CC(C)(C)C(=O)c1ccnn1C1CCOC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.39
FPR1 P21462 1/20 0.36
PDE4D Q08499 1/20 0.36
OPRM1 P35372 3/20 0.35
KMT2A Q03164 1/20 0.35
SPR P35270 1/20 0.35
KDM4C Q9H3R0 3/20 0.35
PDK2 Q15119 2/20 0.35
PDK1 Q15118 1/20 0.35
POLB P06746 1/20 0.34
SRC P12931 1/20 0.34
PDE1A P54750 1/20 0.33
PDE1B Q01064 1/20 0.33
PDE1C Q14123 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 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
SCHEMBL25854000 0.85 PDK2 (0.43) KMT2APDK2PDK1BRD4
SCHEMBL25562690 0.83 CNR2 (0.39) CNR2FPR1OPRM1KMT2ASPR
SCHEMBL22366382 0.82 KDM4C (0.42) CNR2OPRM1KMT2ASPRKDM4C
SCHEMBL22125893 0.82 OPRM1 (0.40) CNR2OPRM1KMT2ASPRKDM4C
SCHEMBL25530147 0.82 PKM (0.40) KMT2APDK2PDK1BRD4
SCHEMBL22319884 0.81 F2 (0.40) OPRM1KMT2ASPRKDM4CPOLB
SCHEMBL25568579 0.77 PDE4D (0.43) FPR1PDE4DOPRM1KMT2ASPR
SCHEMBL17454459 0.75 PIK3CD (0.38) KMT2ABRD4CREBBP
SCHEMBL29629580 0.74 OPRM1 (0.43) OPRM1KMT2AKDM4CPOLBSRC
SCHEMBL29629564 0.74 KDM4C (0.41) OPRM1KMT2AKDM4CPOLB

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-20230227437-A1 IMMUNOMODULATOR HITGEN INC (CN) 2023-07-20 US disclosed
US-20230227437-A1 IMMUNOMODULATOR HITGEN INC (CN) 2023-07-20 US disclosed
US-20230159465-A1 IMMUNOMODULATOR HITGEN INC. (CN) 2023-05-25 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-20230159465-A1 IMMUNOMODULATOR IL2, IL17A, IL2RA CNR2 1434/4885FPR1 262/4885PDE4D 2474/4885
US-20230227437-A1 IMMUNOMODULATOR IL17A, IL2, IL2RA CNR2 1393/4885FPR1 437/4885PDE4D 2033/4885

“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.