SCHEMBL3249739

SCHEMBL3249739

[CH](Cc1ccccc1)C1CC1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.50
TSHR P16473 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
ARG2 P78540 1/20 0.39
G6PC1 P35575 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
GBA1 P04062 1/20 0.38
CALM1 P0DP23 1/20 0.38
MRGPRX1 Q96LB2 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
SCHEMBL7665557 0.91 G6PC1 (0.47) MAOBTSHRG6PC1
SCHEMBL22089795 0.91 MAOB (0.46) MAOBTSHRG6PC1CALM1
SCHEMBL678829 0.89 G6PC1 (0.50) MAOBG6PC1
SCHEMBL676295 0.87 MAOB (0.43) MAOBTSHRCA1CA2ARG2
SCHEMBL9386234 0.86 GBA1 (0.53) MAOBGBA1
SCHEMBL23883324 0.82 MAOB (0.39) MAOBTSHRCA1CA2ARG2
SCHEMBL3189709 0.80 G6PC1 (0.40) MAOBG6PC1
SCHEMBL6584156 0.77 POLB (0.40)
SCHEMBL25239973 0.77 HRH3 (0.44) HRH3
SCHEMBL677308 0.76 G6PC1 (0.40) MAOBG6PC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150328230-A1 CLEARANCE OF AMYLOID BETA SYNAPTEC DEVELOPMENT LLC (US) 2015-11-19 US claimed
WO-2016087593-A1 NOVEL FUNGICIDAL QUINOLINYLAMIDINES SYNGENTA PARTICIPATIONS AG (CH) 2016-06-09 WO disclosed
EP-1167366-B1 AMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2010-05-05 EP disclosed
EP-1390354-A1 TRIAZINYL ACRYLAMIDE DERIVATIVES AS KINASE INHIBITORS Amgen Inc. (US) 2004-02-25 EP disclosed
US-6562849-B1 Amine compound or pharmacologically acceptable salt thereof. These compounds are useful in the treatment and/or prophylaxis of diseases such as diabetes, hyperlipemia, arteriosclerosis, cancer, etc. SANKYO COMPANY, LIMITED (JP) 2003-05-13 US disclosed
US-20030078426-A1 Amine derivative compounds SANKYO COMPANY, LIMITED (JP) 2003-04-24 US disclosed
WO-2002083653-A1 TRIAZINYL ACRYLAMIDE DERIVATIVES AS KINASE INHIBITORS AMGEN INC. (US) 2002-10-24 WO disclosed
EP-1167366-A1 AMINE DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 EP 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 (2 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-20150328230-A1 CLEARANCE OF AMYLOID BETA BACE1, APP, BCHE MAOB 701/4885TSHR 3230/4885CA1 106/4885
US-20030078426-A1 Amine derivative compounds H1-10, APOB, PRMT1 MAOB 860/4885TSHR 2306/4885CA1 2629/4885

“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.