SCHEMBL27100868

SCHEMBL27100868

CC(=O)NC(C)CP(Cc1c(C)cc(C)cc1C)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 9/20 0.41
▸ MTNR1B P49286 9/20 0.41
▸ TACR1 P25103 2/20 0.37
▸ ACACB O00763 4/20 0.36
▸ LMNA P02545 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ TAS1R3 Q7RTX0 1/20 0.34
▸ TAS1R1 Q7RTX1 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
SCHEMBL27100872 0.79 MEN1 (0.34) LMNAPOLB
SCHEMBL26222036 0.78 SLC6A2 (0.34) LMNAPOLB
SCHEMBL19190082 0.76 MEN1 (0.39) LMNA
SCHEMBL27100885 0.75 SLC6A2 (0.35) LMNA
SCHEMBL28042989 0.72 MEN1 (0.40) LMNA
Phosphonic Acid SCHEMBL28952677 0.70 MEN1 (0.35) LMNA
SCHEMBL26222032 0.68 CHRM2 (0.36) LMNAPOLB
SCHEMBL27898432 0.67 MEN1 (0.37) LMNA
SCHEMBL1582351 0.66 MEN1 (0.39) LMNA
SCHEMBL19190077 0.66 LMNA (0.39) LMNA

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-11912800-B2 Amide-functionalized polymerization initiators and their use in the manufacture of ophthalmic lenses JOHNSON & JOHNSON VISION CARE, INC. (US) 2024-02-27 — — 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-11912800-B2 Amide-functionalized polymerization initiators and their use in the manufacture of ophthalmic lenses CRYAA, UACA, CRYAB MTNR1A 2199/4885MTNR1B 2386/4885TACR1 1944/4885

“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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