SCHEMBL25065356

SCHEMBL25065356

CC(C)C1CCCN(c2cnccn2)C1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
ATM Q13315 1/20 0.45
CYP11B2 P19099 1/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL12988997 0.91 KDM4E (0.49) KDM4E
SCHEMBL12988347 0.81 KDM4E (0.55) KDM4E
SCHEMBL25065351 0.81 KCNH2 (0.39) KMT2AATMKDM4E
SCHEMBL14177933 0.80 CYP11B2 (0.49) KMT2AATMCYP11B2KDM4EPOLB
SCHEMBL23498149 0.77 KMT2A (0.48) KMT2AATMPOLBTDP1
SCHEMBL15029579 0.77 KMT2A (0.48) KMT2AATMPOLBTDP1
SCHEMBL21776395 0.77 TDP1 (0.47) KMT2AATMCYP11B2KDM4EPOLB
SCHEMBL22971757 0.77 CHRNB2 (0.51)
SCHEMBL18997049 0.77 POLB (0.46) KMT2AATMCYP11B2KDM4EPOLB
SCHEMBL25065360 0.75 GRM1 (0.39) KMT2AKDM4E

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-20230286997-A1 Compounds for the Treatment of Cancer and Inflammatory Disease SHY Therapeutics LLC 2023-09-14 US disclosed
US-20230055741-A1 FUNCTIONALIZED HETEROCYCLIC COMPOUNDS AS MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) Ryvu Therapeutics S.A. (PL) 2023-02-23 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-20230286997-A1 Compounds for the Treatment of Cancer and Inflammatory Disease MAPK6, MAP3K6, MAPK4 KMT2A 3544/4885ATM 284/4885CYP11B2 1730/4885
US-20230055741-A1 FUNCTIONALIZED HETEROCYCLIC COMPOUNDS AS MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) STING1, IRF3, CGAS KMT2A 3715/4885ATM 772/4885CYP11B2 1231/4885

“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.