SCHEMBL20334476

SCHEMBL20334476

CC(=O)c1cn(CC(=O)OC(C)(C)C)c2ccc(Nc3cnccn3)cc12

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 11/20 0.41
▸ LMNA P02545 4/20 0.39
▸ HTT P42858 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ RXFP1 Q9HBX9 3/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ P2RY12 Q9H244 1/20 0.36
▸ NTRK1 P04629 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ SYK P43405 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
SCHEMBL20334477 0.86 CFD (0.45) CFDLMNAHTTKDM4ETSHR
SCHEMBL19208156 0.86 LMNA (0.46) CFDLMNAHTTKDM4ETSHR
SCHEMBL17023825 0.85 CFD (0.56) CFD
SCHEMBL19208544 0.83 LMNA (0.39) CFDLMNAHTTKDM4ETSHR
SCHEMBL20334288 0.79 CFD (0.42) CFDLMNATSHRRXFP1MEN1
SCHEMBL12479189 0.79 LMNA (0.46) CFDLMNAHTTKDM4ETSHR
SCHEMBL20334307 0.79 EGFR (0.43) CFDTSHRRXFP1MEN1KMT2A
SCHEMBL30378124 0.79 EGFR (0.43) CFDTSHRRXFP1MEN1KMT2A
SCHEMBL30146875 0.77 SMN1; SMN2 (0.41) CFDLMNAHTTTSHRRXFP1
SCHEMBL19208678 0.77 SMN1; SMN2 (0.41) CFDLMNAHTTTSHRRXFP1

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-10660876-B2 Amino compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2020-05-26 — — US disclosed
US-20180177761-A1 AMINO COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2018-06-28 — — 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 (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-10660876-B2 Amino compounds for treatment of medical disorders CFD, CFH, F12 CFD 1/4885LMNA 1013/4885HTT 2392/4885
US-20180177761-A1 AMINO COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, CFH, F12 CFD 1/4885LMNA 1013/4885HTT 2392/4885

“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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