SCHEMBL23664608

SCHEMBL23664608

CC(C)NCc1ccc(C2CCN(CCOCC(C)(C)C)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 8/20 0.41
▸ CYP2C9 P11712 5/20 0.41
▸ KCNH2 Q12809 3/20 0.40
▸ CYP3A4 P08684 3/20 0.40
▸ CARM1 Q86X55 2/20 0.39
▸ PRMT6 Q96LA8 2/20 0.39
▸ DRD2 P14416 2/20 0.39
▸ SLC18A3 Q16572 1/20 0.39
▸ HRH1 P35367 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.37

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
SCHEMBL22965358 0.87 CARM1 (0.45) HRH3CYP2C9CYP3A4CARM1PRMT6
SCHEMBL18592218 0.86 DRD2 (0.40) HRH3CYP2C9KCNH2CYP3A4CARM1
SCHEMBL21965867 0.82 DRD2 (0.46) DRD2SLC18A3
SCHEMBL23664607 0.81 NCF1 (0.40) HRH3DRD2HRH1
SCHEMBL18591774 0.80 PRCP (0.42) CARM1PRMT6DRD2SLC18A3
SCHEMBL25053674 0.75 DRD2 (0.44) HRH3CYP2C9DRD2SLC18A3HRH1
SCHEMBL24654217 0.70 LTA4H (0.38) HRH3CYP2C9CYP3A4
SCHEMBL22692312 0.68 SIGMAR1 (0.35) HRH3KCNH2CARM1PRMT6HRH1
SCHEMBL18591747 0.67 DRD4 (0.41) HRH3DRD2HRH1SIGMAR1
SCHEMBL24673680 0.66 DRD2 (0.43) CYP3A4CARM1PRMT6DRD2SLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210220475-A1 EGFR PROTEOLYSIS TARGETING CHIMERIC MOLECULES AND ASSOCIATED METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-07-22 — — 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 (1 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-20210220475-A1 EGFR PROTEOLYSIS TARGETING CHIMERIC MOLECULES AND ASSOCIATED METHODS OF USE TBK1, EGFR, CBL HRH3 3301/4885CYP2C9 4703/4885KCNH2 4851/4885

“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.

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