SCHEMBL20293753

SCHEMBL20293753

COCCOc1ccc(Nc2ccc3c(c2)c(C(C)=O)cn3CC(=O)O)cn1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.46
▸ CFD P00746 5/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ TSHR P16473 1/20 0.41
▸ P2RY12 Q9H244 2/20 0.41
▸ ITK Q08881 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KMT2A Q03164 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ OPRM1 P35372 2/20 0.37
▸ IDO1 P14902 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
SCHEMBL18556192 0.90 CFD (0.44) CFDSMN1; SMN2TSHRP2RY12ALDH1A1
SCHEMBL20334307 0.88 EGFR (0.43) EGFRCFDSMN1; SMN2TSHRP2RY12
SCHEMBL30378124 0.88 EGFR (0.43) EGFRCFDSMN1; SMN2TSHRP2RY12
SCHEMBL20334465 0.82 CFD (0.49) CFDSMN1; SMN2P2RY12ALDH1A1LMNA
SCHEMBL29781676 0.79 CFD (0.61) CFD
SCHEMBL17023687 0.79 CFD (0.61) CFD
SCHEMBL20334288 0.78 CFD (0.42) CFDSMN1; SMN2TSHRP2RY12LMNA
SCHEMBL29781699 0.78 LMNA (0.51) CFDSMN1; SMN2TSHRP2RY12ALDH1A1
SCHEMBL19208556 0.78 LMNA (0.51) CFDSMN1; SMN2TSHRP2RY12ALDH1A1
SCHEMBL18554722 0.76 SMN1; SMN2 (0.34) EGFRCFDSMN1; SMN2TSHRP2RY12

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11649223-B2 Amino compounds for treatment of immune and inflammatory disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-05-16 — — US disclosed
US-20210122733-A1 AMINO COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS ACHILLION PHARMACEUTICALS, INC. 2021-04-29 — — US disclosed
US-10906887-B2 Amino compounds for treatment of immune and inflammatory disorders ACHILLION PHARMACEUTICALS, INC. (US) 2021-02-02 — — US disclosed
US-20180179185-A1 AMINO COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY 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 (4 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-20210122733-A1 AMINO COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS CFD, TFPI, CFH EGFR 856/4885CFD 1/4885SMN1; SMN2 4623/4885
US-20180179185-A1 AMINO COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS CFD, TFPI, CFH EGFR 856/4885CFD 1/4885SMN1; SMN2 4623/4885
US-11649223-B2 Amino compounds for treatment of immune and inflammatory disorders CFD, TFPI, CFH EGFR 856/4885CFD 1/4885SMN1; SMN2 4623/4885
US-10906887-B2 Amino compounds for treatment of immune and inflammatory disorders CFD, TFPI, CFH EGFR 856/4885CFD 1/4885SMN1; SMN2 4623/4885

“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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