SCHEMBL17809627

SCHEMBL17809627

CN1CCc2cc(F)c(-c3cnn(C)c3)cc21

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 4/20 0.42
▸ GSK3B P49841 6/20 0.42
▸ DYRK1A Q13627 6/20 0.42
▸ WNT1 P04628 5/20 0.42
▸ USP30 Q70CQ3 4/20 0.40
▸ ALOX5AP P20292 1/20 0.39
▸ FEN1 P39748 1/20 0.39
▸ CYP11B2 P19099 2/20 0.38
▸ SCD O00767 1/20 0.38
▸ WDR5 P61964 1/20 0.38
▸ BRD4 O60885 1/20 0.37
▸ ERN1 O75460 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
SCHEMBL17809502 0.94 CREBBP (0.44) CREBBPGSK3BDYRK1AWNT1USP30
SCHEMBL17809572 0.86 CREBBP (0.50) CREBBPBRD4
SCHEMBL19368731 0.84 WNT1 (0.41) CREBBPGSK3BDYRK1AWNT1USP30
SCHEMBL17806213 0.84 CREBBP (0.41) CREBBPGSK3BDYRK1AWNT1USP30
SCHEMBL17785617 0.82 CYP11B2 (0.49) CREBBPGSK3BDYRK1AWNT1USP30
SCHEMBL17794569 0.81 USP30 (0.53) CREBBPUSP30WDR5BRD4
SCHEMBL17809634 0.80 CREBBP (0.57) CREBBPBRD4
SCHEMBL22369071 0.79 CREBBP (0.48) CREBBPBRD4
SCHEMBL17806203 0.79 CREBBP (0.44) CREBBPGSK3BDYRK1AWNT1USP30
SCHEMBL17809646 0.78 USP30 (0.58) CREBBPUSP30WDR5

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-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-23 — — US disclosed
US-9763922-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2017-09-19 — — US disclosed
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-06-09 — — 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-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 CREBBP 6/4885GSK3B 2555/4885DYRK1A 4494/4885
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 CREBBP 6/4885GSK3B 2555/4885DYRK1A 4494/4885

“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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