SCHEMBL19902522

SCHEMBL19902522

CC(C)n1cc(-c2ccn3c(C(=O)N[C@H]4CC[C@H](c5n[nH]c(=O)c6ccccc65)CC4)cnc3c2)cn1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.46
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
ROCK1 Q13464 2/20 0.40
ROCK2 O75116 2/20 0.39
CSF1R P07333 8/20 0.37
TGFBR1 P36897 1/20 0.37
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
HAT1 O14929 2/20 0.36
EP300 Q09472 2/20 0.36
RIPK2 O43353 1/20 0.35

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
SCHEMBL19902655 0.91 USP30 (0.56) USP30ROCK1ROCK2CSF1RHAT1
SCHEMBL17452985 0.91 ROCK2 (0.51) USP30PRMT5WDR77ROCK1ROCK2
SCHEMBL19902637 0.88 USP30 (0.46) USP30PRMT5WDR77ROCK1ROCK2
SCHEMBL19902392 0.88 ROCK1 (0.43) USP30ROCK1ROCK2CSF1RTGFBR1
SCHEMBL19902725 0.85 ROCK1 (0.38) USP30ROCK1ROCK2CSF1RTGFBR1
SCHEMBL19902648 0.85 ROCK1 (0.43) USP30ROCK1ROCK2CSF1RTGFBR1
SCHEMBL19902368 0.85 ROCK1 (0.49) USP30PRMT5WDR77ROCK1ROCK2
SCHEMBL19902485 0.85 ROCK1 (0.47) USP30ROCK1ROCK2TGFBR1
SCHEMBL19902532 0.84 DYRK1A (0.46) USP30ROCK1ROCK2
SCHEMBL19902410 0.84 ROCK1 (0.45) ROCK1ROCK2CSF1RCCNA2CDK2

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 3527/4885PRMT5 1304/4885WDR77 3323/4885

“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.