SCHEMBL13637642

SCHEMBL13637642

CCCC1(C(=O)NCCc2cccc(C(=O)O)c2)CC[C@]2(C)C(CCC3C4(C)CCC(=O)C(C)(C)C4CCC32C)C1C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ GPBAR1 Q8TDU6 2/20 0.41
▸ NT5E P21589 1/20 0.41
▸ PTPN1 P18031 2/20 0.38
▸ ACP1 P24666 2/20 0.38
▸ PTPRF P10586 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ NR1H2 P55055 1/20 0.33
▸ NR1H3 Q13133 1/20 0.33

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
SCHEMBL13637643 0.84 ROCK2 (0.33) LMNASMN1; SMN2GPBAR1NT5EPTPN1
SCHEMBL13637647 0.81 TRPV1 (0.40) PTPN1
SCHEMBL13628265 0.81 GPBAR1 (0.64) LMNASMN1; SMN2GPBAR1NT5E
SCHEMBL13637784 0.80 RORC (0.37) GPBAR1PTPN1
SCHEMBL13637720 0.80 RORC (0.38) LMNANT5EPTPN1
SCHEMBL13637718 0.79 RORC (0.38) NT5EPTPN1
SCHEMBL13637724 0.78 TRPV1 (0.41) LMNAGPBAR1NT5EPTPN1
SCHEMBL13637788 0.78 TRPV1 (0.38) LMNANT5EPTPN1
SCHEMBL13637475 0.78 RORC (0.38) PTPN1
SCHEMBL13637675 0.78 TRPV1 (0.42) PTPN1

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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2009-11-05 — — 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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MAVS, ZC3HAV1, EIF2AK2 LMNA 2620/4885SMN1; SMN2 1983/4885GPBAR1 3262/4885

“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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