SCHEMBL18556192

SCHEMBL18556192

COCCOc1ncc(Nc2ccc3c(c2)c(C(C)=O)cn3CC(=O)O)cn1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 10/20 0.44
▸ SMN1; SMN2 Q16637 5/20 0.42
▸ TSHR P16473 1/20 0.42
▸ P2RY12 Q9H244 2/20 0.41
▸ LMNA P02545 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ RXFP1 Q9HBX9 3/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HTT P42858 1/20 0.37

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
SCHEMBL20293753 0.90 EGFR (0.46) CFDSMN1; SMN2TSHRP2RY12LMNA
SCHEMBL20334288 0.88 CFD (0.42) CFDSMN1; SMN2TSHRP2RY12LMNA
SCHEMBL20334465 0.85 CFD (0.49) CFDSMN1; SMN2P2RY12LMNAALDH1A1
SCHEMBL17023687 0.81 CFD (0.61) CFD
SCHEMBL29781676 0.81 CFD (0.61) CFD
SCHEMBL20334307 0.78 EGFR (0.43) CFDSMN1; SMN2TSHRP2RY12RXFP1
SCHEMBL30378124 0.78 EGFR (0.43) CFDSMN1; SMN2TSHRP2RY12RXFP1
SCHEMBL19208556 0.77 LMNA (0.51) CFDSMN1; SMN2TSHRP2RY12LMNA
SCHEMBL29781699 0.77 LMNA (0.51) CFDSMN1; SMN2TSHRP2RY12LMNA
SCHEMBL20333849 0.76 CFD (0.51) CFDSMN1; SMN2P2RY12LMNAALDH1A1

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 5 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-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
US-20180177761-A1 AMINO COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2018-06-28 — — US disclosed
WO-2017035351-A1 AMINO COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-02 — — WO 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 1/4885SMN1; SMN2 1899/4885TSHR 2074/4885
US-20180177761-A1 AMINO COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, CFH, F12 CFD 1/4885SMN1; SMN2 1899/4885TSHR 2074/4885

“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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