SCHEMBL20378086

SCHEMBL20378086

COC(=O)c1cccc(NC(=O)C2CC(F)CN2C(=O)O)c1F

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 11/20 0.47
▸ TSHR P16473 4/20 0.41
▸ HSD17B10 Q99714 5/20 0.41
▸ KDM4E B2RXH2 5/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ EP300 Q09472 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ LMNA P02545 1/20 0.41

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
SCHEMBL18554390 0.87 CYP1A2 (0.47) CFDTSHRHSD17B10KDM4EALDH1A1
SCHEMBL22542871 0.87 CYP1A2 (0.47) CFDTSHRHSD17B10KDM4EALDH1A1
SCHEMBL18556088 0.86 CFD (0.51) CFDEP300
SCHEMBL18549683 0.83 CFD (0.48) CFD
SCHEMBL18554393 0.83 CFD (0.48) CFD
SCHEMBL18549648 0.81 CFD (0.42) CFDEP300
SCHEMBL18549650 0.81 CFD (0.42) CFDEP300
SCHEMBL18578247 0.80 CFD (0.64) CFD
SCHEMBL17026550 0.77 CFD (0.57) CFD
SCHEMBL17023499 0.77 CFD (0.57) CFD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3340982-B1 COMPOUNDS FOR TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2021-12-15 — — EP disclosed
US-10807952-B2 Compounds for treatment of immune inflammatory disorders ACHILLION PHARMACEUTICALS, INC. (US) 2020-10-20 — — US disclosed
US-20180201580-A1 COMPOUNDS FOR TREATMENT OF IMMUNE INFLAMMATORY DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2018-07-19 — — 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-10807952-B2 Compounds for treatment of immune inflammatory disorders CFD, TFPI, CFH CFD 1/4885TSHR 4174/4885HSD17B10 2354/4885
US-20180201580-A1 COMPOUNDS FOR TREATMENT OF IMMUNE INFLAMMATORY DISORDERS CFD, TFPI, CFH CFD 1/4885TSHR 4174/4885HSD17B10 2354/4885

“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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