SCHEMBL18562157

SCHEMBL18562157

COC(=O)Cn1nc(C(C)=O)c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.65
▸ SMN1; SMN2 Q16637 2/20 0.65
▸ KMT2A Q03164 2/20 0.65
▸ ALDH1A1 P00352 1/20 0.65
▸ LMNA P02545 1/20 0.65
▸ HPGD P15428 1/20 0.65
▸ HTT P42858 1/20 0.65
▸ MAPT P10636 1/20 0.51
▸ TSHR P16473 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.49
▸ CFD P00746 11/20 0.47
▸ GAA P10253 2/20 0.47
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46

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
SCHEMBL12480155 0.85 KDM4E (0.48) KDM4ESMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL12481560 0.84 HSD17B10 (0.61) KDM4ESMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL29781847 0.84 HSD17B10 (0.61) KDM4ESMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL19236739 0.83 KDM4E (0.46) KDM4ESMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL19261506 0.82 KDM4E (0.55) KDM4ESMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL17024805 0.82 CFD (0.50) CFD
SCHEMBL12480168 0.82 MAPT (0.48) KDM4ESMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL20488598 0.81 MAPT (0.47) KDM4ESMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL15622512 0.81 KDM4E (0.67) KDM4ESMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL25097124 0.80 KDM4E (0.43) KDM4ESMN1; SMN2KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170056428-A1 Compounds for the Treatment of Medical Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-02 — — US disclosed
US-20170056428-A1 Compounds for the Treatment of Medical Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-02 — — 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-20170056428-A1 Compounds for the Treatment of Medical Disorders CFD, TFPI, CFH KDM4E 4533/4885SMN1; SMN2 3336/4885KMT2A 4742/4885

“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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