SCHEMBL14776567

SCHEMBL14776567

N#Cc1nn(CCC(F)(F)F)c2ncccc12

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 10/20 0.46
▸ PDE5A O76074 2/20 0.38
▸ KDM4D Q6B0I6 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ HTR2B P41595 1/20 0.36
▸ HTR3A P46098 1/20 0.36
▸ HTR4 Q13639 1/20 0.36
▸ MAT2A P31153 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ METAP2 P50579 2/20 0.34

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
SCHEMBL10070616 0.89 ELANE (0.44) ELANE
SCHEMBL20140623 0.82 ELANE (0.45) ELANEKDM4DL3MBTL1MAT2AMETAP2
SCHEMBL7907355 0.80 ELANE (0.43) ELANEL3MBTL1HTR2BHTR3AHTR4
SCHEMBL9925305 0.80 ELANE (0.50) ELANEKDM4DL3MBTL1
SCHEMBL10063592 0.79 ELANE (0.47) ELANEKDM4DL3MBTL1
SCHEMBL31469634 0.78 GUCY1A1 (0.34) MAT2A
SCHEMBL17435113 0.78 GUCY1A1 (0.34) MAT2A
SCHEMBL20140783 0.76 L3MBTL1 (0.63) ELANEL3MBTL1KDM4E
SCHEMBL20140434 0.76 L3MBTL1 (0.46) ELANEL3MBTL1KDM4E
SCHEMBL2882941 0.76 ELANE (0.44) ELANEPDE5AL3MBTL1KDM4E

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
US-9365574-B2 Soluble guanylate cyclase activators MERCK SHARP & DOHME CORP. (US) 2016-06-14 — — US disclosed
EP-2575473-B1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME (US) 2016-01-20 — — EP disclosed
US-20130072492-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME LLC 2013-03-21 — — 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-20130072492-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS GUCY1A2, GUCY1A1, PDE2A ELANE 1617/4885PDE5A 7/4885KDM4D 4290/4885

“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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