SCHEMBL20008968

SCHEMBL20008968

CC(C)OC1CCN(c2ccccc2)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 8/20 0.50
▸ NOTUM Q6P988 2/20 0.46
▸ PRMT5 O14744 1/20 0.43
▸ WDR77 Q9BQA1 1/20 0.43
▸ HRH3 Q9Y5N1 2/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ DRD1 P21728 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ DPP4 P27487 2/20 0.41
▸ MBTD1 Q05BQ5 1/20 0.41
▸ L3MBTL3 Q96JM7 1/20 0.41

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
SCHEMBL20009019 0.90 PRMT5 (0.46) ACACBNOTUMPRMT5WDR77CYP2D6
SCHEMBL348868 0.83 ACACB (0.54) ACACBNOTUMPRMT5WDR77FFAR4
SCHEMBL13486520 0.81 NOTUM (0.50) ACACBNOTUMPRMT5WDR77DPP4
SCHEMBL23844510 0.77 NOTUM (0.50) ACACBNOTUMOPRM1DPP4MBTD1
SCHEMBL20012514 0.76 PRMT5 (0.45) ACACBPRMT5WDR77CYP2D6DPP4
SCHEMBL17392419 0.74 NOTUM (0.55) ACACBNOTUMPRMT5WDR77CHRM1
SCHEMBL17392415 0.74 NOTUM (0.55) ACACBNOTUMPRMT5WDR77CHRM1
SCHEMBL25364252 0.74 NOTUM (0.47) ACACBNOTUMPRMT5WDR77CYP2D6
SCHEMBL12236005 0.73 MAPT (0.49) ACACBHRH3L3MBTL3L3MBTL1MAPK1
SCHEMBL19011534 0.73 NOTUM (0.46) ACACBNOTUMPRMT5WDR77DPP4

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-10308614-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-06-04 — — US disclosed
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-03-29 — — US disclosed
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-03-29 — — 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-10308614-B2 Therapeutic compounds and uses thereof SMARCC1, SMARCC2, SMARCA4 ACACB 3506/4885NOTUM 4685/4885PRMT5 282/4885
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF SMARCC1, SMARCC2, SMARCA4 ACACB 3506/4885NOTUM 4685/4885PRMT5 282/4885

“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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