SCHEMBL20681007

SCHEMBL20681007

CCC#Cc1ccc(OCOC)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HAO1 Q9UJM8 1/20 0.40
▸ CHRNB2 P17787 1/20 0.39
▸ CHRNB4 P30926 1/20 0.39
▸ CHRNA3 P32297 1/20 0.39
▸ CHRNA7 P36544 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ NQO1 P15559 1/20 0.38
▸ MCHR1 Q99705 1/20 0.37
▸ APP P05067 2/20 0.37
▸ GABRP O00591 1/20 0.36
▸ GABRD O14764 1/20 0.36
▸ GABRA1 P14867 1/20 0.36
▸ GABRB1 P18505 1/20 0.36
▸ GABRG2 P18507 1/20 0.36
▸ GABRB3 P28472 1/20 0.36
▸ GABRA5 P31644 1/20 0.36
▸ GABRA3 P34903 1/20 0.36
▸ GABRA2 P47869 1/20 0.36
▸ GABRB2 P47870 1/20 0.36
▸ GABRA4 P48169 1/20 0.36

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
SCHEMBL13170580 0.86 APP (0.48) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL20607767 0.83 HRH3 (0.48) APPGABRPGABRDGABRA1GABRB1
SCHEMBL17484514 0.83 ACACB (0.46) HAO1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL21715143 0.82 APP (0.41) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL10102350 0.82 APP (0.55) HAO1MCHR1APPACACB
SCHEMBL9335394 0.80 NQO1 (0.58) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL9332942 0.80 APP (0.59) HAO1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL9509270 0.79 CYP2A6 (0.44) MCHR1APPACACB
SCHEMBL26668462 0.79 HRH3 (0.44) MCHR1APPGABRPGABRDGABRA1
SCHEMBL18290925 0.78 LTA4H (0.50) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4

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
US-20210094899-A1 ACRYLIC ACID ANALOGS RECURIUM IP HOLDINGS, LLC 2021-04-01 — — US disclosed
EP-3658527-A1 ACRYLIC ACID ANALOGS Recurium IP Holdings, LLC (US) 2020-06-03 — — EP disclosed
CN-111094227-A Acrylic acid analogues 里科瑞尔姆IP控股有限责任公司 2020-05-01 — — CN disclosed
WO-2019023481-A1 ACRYLIC ACID ANALOGS Zeno Royalties & Milestones, LLC (US) 2019-01-31 — — WO 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-20210094899-A1 ACRYLIC ACID ANALOGS BRCA1, ASS1, MKI67 HAO1 1184/4885CHRNB2 4547/4885CHRNB4 4792/4885

“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.

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