SCHEMBL19628541

SCHEMBL19628541

CCc1cc(C#N)c(-c2cnn(C)c2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.42
BRD4 O60885 3/20 0.41
CREBBP Q92793 3/20 0.41
RET P07949 6/20 0.40
SRPK2 P78362 1/20 0.40
SRPK1 Q96SB4 1/20 0.40
EML4 Q9HC35 1/20 0.40
ALK Q9UM73 1/20 0.40
CHRM1 P11229 2/20 0.39
CHRM5 P08912 1/20 0.39
RIPK3 Q9Y572 1/20 0.39
GRM4 Q14833 1/20 0.38
BAZ2B Q9UIF8 1/20 0.38
BAZ2A Q9UIF9 1/20 0.38
ERN1 O75460 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
SCHEMBL17794961 0.83 CHRM1 (0.44) CHRM1CHRM5ERN1
SCHEMBL17809692 0.82 USP30 (0.42) USP30BRD4CREBBPRETGRM4
SCHEMBL19538863 0.79 BRD4 (0.47) USP30BRD4CREBBPGRM4BAZ2B
SCHEMBL17806584 0.79 LRRK2 (0.41) USP30BRD4CREBBPRETGRM4
SCHEMBL19531703 0.76 LRRK2 (0.48) USP30BRD4CREBBPCNR1CNR2
SCHEMBL17795290 0.75 USP30 (0.39) USP30RETSRPK2SRPK1EML4
SCHEMBL23761239 0.75 PIK3CD (0.47) USP30RETRIPK3CNR1CNR2
SCHEMBL17809747 0.72 USP30 (0.50) USP30CREBBPRETCNR1CNR2
SCHEMBL25378962 0.72 CYP11B1 (0.48) RETRIPK3CNR1CNR2
SCHEMBL17795599 0.72 USP30 (0.39) USP30CREBBPRETSRPK2SRPK1

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 1 patent. 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 2156/4885BRD4 11/4885CREBBP 6/4885

“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.