SCHEMBL17809596

SCHEMBL17809596

CNC(=O)c1ccc(-c2cc3c(cc2C#N)N(C)CCC3)cn1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 4/20 0.43
BRD4 O60885 3/20 0.43
USP30 Q70CQ3 1/20 0.42
AR P10275 5/20 0.42
OTUD7B Q6GQQ9 2/20 0.42
KDM1A O60341 1/20 0.41
CYP11B2 P19099 2/20 0.41
PIP5K1C O60331 1/20 0.39
PIK3CA P42336 1/20 0.39
PI4KA P42356 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
SCD O00767 1/20 0.39
MAPT P10636 1/20 0.38
XIAP P98170 1/20 0.38
BIRC2 Q13490 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38

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
SCHEMBL17806331 0.87 CREBBP (0.43) CREBBPBRD4USP30AROTUD7B
SCHEMBL17809789 0.86 CREBBP (0.44) CREBBPBRD4USP30OTUD7BCYP11B2
SCHEMBL17794998 0.85 ABL1 (0.38) CREBBPUSP30AR
SCHEMBL17795001 0.84 CYP11B2 (0.38) CREBBPUSP30CYP11B2
SCHEMBL17809792 0.83 CYP11B2 (0.39) USP30CYP11B2
SCHEMBL17794572 0.83 CREBBP (0.59) CREBBPBRD4
SCHEMBL17809553 0.83 OTUD7B (0.48) CREBBPBRD4USP30OTUD7BCYP11B2
SCHEMBL17809671 0.82 MAPT (0.47) CREBBPBRD4USP30OTUD7BCYP11B2
SCHEMBL17809677 0.82 CYP11B2 (0.41) CREBBPBRD4CYP11B2SCD
SCHEMBL17809654 0.82 CYP11B2 (0.41) USP30KDM1ACYP11B2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 (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 6/4885BRD4 11/4885USP30 2156/4885
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 CREBBP 6/4885BRD4 11/4885USP30 2156/4885

“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.