SCHEMBL7112079

SCHEMBL7112079

CCN(C(=O)OC(C)(C)C)c1ccc(Cl)cc1CO

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 8/20 0.40
PSEN2 P49810 8/20 0.40
APH1B Q8WW43 8/20 0.40
NCSTN Q92542 8/20 0.40
APH1A Q96BI3 8/20 0.40
PSENEN Q9NZ42 8/20 0.40
MAPT P10636 1/20 0.39
CYP3A4 P08684 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 2/20 0.36
MCOLN3 Q8TDD5 1/20 0.36
TSHR P16473 1/20 0.36
FDFT1 P37268 1/20 0.36
SLC6A4 P31645 1/20 0.35
MT-CO2 P00403 1/20 0.34
IDO1 P14902 1/20 0.34

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
SCHEMBL7108590 0.88 CYP3A4 (0.37) MAPTCYP3A4MEN1KMT2AGAA
SCHEMBL21865632 0.79 PSEN1 (0.45) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28371791 0.79 CYP3A4 (0.44) CYP3A4MEN1KMT2AGAAMCOLN3
SCHEMBL28368453 0.79 PSEN1 (0.42) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28261500 0.77 TSHR (0.41) MAPTCYP3A4MEN1KMT2AGAA
SCHEMBL29835191 0.77 ABL1 (0.46) MAPTCYP3A4MEN1KMT2AGAA
SCHEMBL21865763 0.76 PSEN1 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27906122 0.75 AAK1 (0.41) CYP3A4MEN1KMT2AGAAMCOLN3
SCHEMBL21865636 0.73 PSEN1 (0.45) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7375645 0.72 TSHR (0.37) MAPTCYP3A4GAATSHR

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-20030158218-A1 Thrombin inhibitors NANTERMET PHILIPPE G (US) 2003-08-21 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-20030158218-A1 Thrombin inhibitors F2, SERPINC1, TFPI PSEN1 3732/4885PSEN2 4308/4885APH1B 595/4885

“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.