SCHEMBL17809642

SCHEMBL17809642

C[C@H]1CCN(C)c2cc(C#N)c(-c3cnn(C)c3)cc21

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.48
CREBBP Q92793 2/20 0.39
RET P07949 11/20 0.39
PIK3CD O00329 3/20 0.39
PIK3R1 P27986 3/20 0.39
FGFR3 P22607 1/20 0.39
MAP4K1 Q92918 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 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
SCHEMBL17809595 1.00 USP30 (0.48) USP30CREBBPRETPIK3CDPIK3R1
SCHEMBL17809641 1.00 USP30 (0.48) USP30CREBBPRETPIK3CDPIK3R1
SCHEMBL17806311 0.86 USP30 (0.48) USP30RETPIK3CDPIK3R1
SCHEMBL17806251 0.86 USP30 (0.48) USP30RETPIK3CDPIK3R1
SCHEMBL17806334 0.86 USP30 (0.48) USP30RETPIK3CDPIK3R1
SCHEMBL17809747 0.82 USP30 (0.50) USP30CREBBPRETPIK3CDPIK3R1
SCHEMBL17809646 0.79 USP30 (0.58) USP30CREBBPRETPIK3CDPIK3R1
SCHEMBL17795237 0.79 CREBBP (0.47) CREBBP
SCHEMBL17809760 0.79 CREBBP (0.47) CREBBP
SCHEMBL17795234 0.79 CREBBP (0.47) CREBBP

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 4 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
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 USP30 2156/4885CREBBP 6/4885RET 855/4885
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 USP30 2156/4885CREBBP 6/4885RET 855/4885

“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.