SCHEMBL19902655

SCHEMBL19902655

Cn1cc(-c2ccn3c(C(=O)N[C@H]4CC[C@H](c5n[nH]c(=O)c6ccccc65)CC4)cnc3c2)cn1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.56
CSF1R P07333 2/20 0.43
HAT1 O14929 2/20 0.42
EP300 Q09472 2/20 0.42
ROCK1 Q13464 3/20 0.42
GSK3B P49841 4/20 0.41
DYRK1A Q13627 4/20 0.41
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
ROCK2 O75116 2/20 0.41
CLK1 P49759 1/20 0.41
PDGFRA P16234 2/20 0.40
FLT3 P36888 1/20 0.40
NEK2 P51955 1/20 0.40

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
SCHEMBL19902522 0.91 USP30 (0.46) USP30CSF1RHAT1EP300ROCK1
SCHEMBL19902637 0.91 USP30 (0.46) USP30CSF1RHAT1EP300ROCK1
SCHEMBL19902392 0.90 ROCK1 (0.43) USP30CSF1RROCK1DYRK1AROCK2
SCHEMBL17452958 0.90 ROCK2 (0.53) USP30CSF1RHAT1EP300ROCK1
SCHEMBL19902368 0.88 ROCK1 (0.49) USP30CSF1RROCK1ROCK2
SCHEMBL19902485 0.88 ROCK1 (0.47) USP30ROCK1GSK3BDYRK1AROCK2
SCHEMBL19902532 0.87 DYRK1A (0.46) USP30ROCK1DYRK1AROCK2
SCHEMBL17452960 0.86 ROCK2 (0.54) USP30CSF1RHAT1EP300ROCK1
SCHEMBL19902648 0.85 ROCK1 (0.43) USP30CSF1RROCK1ROCK2
SCHEMBL20229984 0.85 ROCK1 (0.42) USP30CSF1RROCK1GSK3BDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180155296-A1 SPIROCYCLOHEPTANES AS INHIBITORS OF ROCK BRISTOL MYERS SQUIBB CO (US) 2018-06-07 US disclosed
US-9902702-B2 Spirocycloheptanes as inhibitors of rock BRISTOL-MYERS SQUIBB COMPANY (US) 2018-02-27 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-20180155296-A1 SPIROCYCLOHEPTANES AS INHIBITORS OF ROCK ROCK1, MYLK, ROCK2 USP30 3527/4885CSF1R 2895/4885HAT1 3907/4885

“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.