SCHEMBL23762153

SCHEMBL23762153

C#Cc1cn(COCC[Si](C)(C)C)c2nccc(Oc3ccc4c(c3)CN(C(=O)OC(C)(C)C)CC4)c12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.40
▸ ACACB O00763 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ MAPT P10636 2/20 0.32
▸ HRH3 Q9Y5N1 3/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ PTK2 Q05397 1/20 0.32
▸ P2RX3 P56373 2/20 0.31
▸ PORCN Q9H237 1/20 0.31
▸ ABCB1 P08183 3/20 0.31
▸ RET P07949 2/20 0.31
▸ GPR119 Q8TDV5 1/20 0.30
▸ IGF1R P08069 1/20 0.30
▸ F10 P00742 1/20 0.30

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
SCHEMBL29836536 1.00 NR1H2 (0.40) NR1H2ACACBESR2MAPTHRH3
SCHEMBL29372226 0.93 NR1H2 (0.40) NR1H2ACACBESR2MAPTP2RX3
SCHEMBL29836550 0.92 NR1H2 (0.39) NR1H2ACACBESR2MAPTHRH3
SCHEMBL23762172 0.92 NR1H2 (0.39) NR1H2ACACBESR2MAPTHRH3
SCHEMBL23762154 0.91 NR1H2 (0.39) NR1H2ACACBESR2MAPTHRH3
SCHEMBL23751145 0.91 HRH3 (0.34) HRH3PORCNABCB1F10
SCHEMBL22802664 0.90 NR1H2 (0.42) NR1H2ACACBESR2MAPTHRH3
SCHEMBL29371186 0.90 NR1H2 (0.42) NR1H2ACACBESR2MAPTHRH3
SCHEMBL23762087 0.89 NR1H2 (0.41) NR1H2ACACBESR2MAPTHRH3
SCHEMBL29368831 0.89 NR1H2 (0.41) NR1H2ACACBESR2MAPTHRH3

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-20210253568-A1 AZAINDOLE DERIVATIVES AS RHO-KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2021-08-19 — — 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-20210253568-A1 AZAINDOLE DERIVATIVES AS RHO-KINASE INHIBITORS ROCK1, ROCK2, RHOA NR1H2 1422/4885ACACB 2494/4885ESR2 3940/4885

“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.

Send feedback