SCHEMBL17809646

SCHEMBL17809646

CN1CCc2cc(-c3cnn(C)c3)c(C#N)cc21

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.58
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
LRRK2 Q5S007 2/20 0.40
WDR5 P61964 1/20 0.39
CREBBP Q92793 6/20 0.38
RET P07949 5/20 0.38
PIK3CD O00329 1/20 0.38
PIK3R1 P27986 1/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
FGFR3 P22607 1/20 0.37
MAP4K1 Q92918 1/20 0.36

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
SCHEMBL17794569 0.95 USP30 (0.53) USP30CNR1CNR2LRRK2WDR5
SCHEMBL17809629 0.92 USP30 (0.53) USP30LRRK2CREBBP
SCHEMBL17809747 0.87 USP30 (0.50) USP30CNR1CNR2LRRK2CREBBP
SCHEMBL17806382 0.86 USP30 (0.55) USP30CNR1CNR2LRRK2CREBBP
SCHEMBL19272700 0.84 USP30 (0.56) USP30CNR1CNR2LRRK2CREBBP
SCHEMBL17809580 0.81 USP30 (0.51) USP30CNR1CNR2CREBBPPIK3CD
SCHEMBL17809788 0.81 USP30 (0.51) USP30CNR1CNR2CREBBPPIK3CD
SCHEMBL17809794 0.81 USP30 (0.51) USP30CNR1CNR2CREBBPPIK3CD
SCHEMBL17809502 0.81 CREBBP (0.44) USP30CREBBP
SCHEMBL17806247 0.81 USP30 (0.50) USP30CNR1CNR2LRRK2CREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3204360-B1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH INC (US) 2020-08-26 EP disclosed
EP-3224258-B1 4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDIN-3-AMINE COMPOUNDS AS CBP AND/OR EP300 INHIBITORS GENENTECH INC (US) 2019-08-14 EP disclosed
US-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-23 US disclosed
US-20170312292-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF WUXI APPTEC (SHANGHAI) CO. LTD (CN) 2017-11-02 US disclosed
US-9763922-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2017-09-19 US disclosed
WO-2016086200-A9 4,5,6,7-TETRAHYDRO-1 H-PYRAZOLO[4,3-C]PYRIDIN-3-AMINE COMPOUNDS AS CBP AND/OR EP300 INHIBITORS GENENTECH, INC. (US) 2016-06-23 WO 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 (3 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 USP30 2156/4885CNR1 549/4885CNR2 804/4885
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 USP30 2156/4885CNR1 549/4885CNR2 804/4885
US-20170312292-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, CREBBP, HDAC1 USP30 1988/4885CNR1 867/4885CNR2 1024/4885

“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.