SCHEMBL19251150

SCHEMBL19251150

CON(C)C(=O)Cc1ncc(C(C)C)cn1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.37
▸ BCHE P06276 10/20 0.35
▸ ACHE P22303 10/20 0.35
▸ HDAC4 P56524 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ OXTR P30559 1/20 0.34
▸ SLC6A2 P23975 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ SLC6A3 Q01959 1/20 0.32
▸ PRMT3 O60678 1/20 0.32
▸ CACNA1H O95180 1/20 0.31
▸ HPGD P15428 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ NPC1 O15118 1/20 0.30

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
SCHEMBL12457520 0.83 BCHE (0.36) FAAHBCHEACHEHDAC4HDAC6
SCHEMBL16330628 0.81 HDAC4 (0.37) FAAHBCHEACHEHDAC4HDAC6
SCHEMBL18505712 0.80 HDAC4 (0.37) FAAHBCHEACHEHDAC4HDAC6
SCHEMBL12459149 0.79 HDAC4 (0.36) FAAHBCHEACHEHDAC4HDAC6
SCHEMBL19756422 0.78 MAPT (0.39) CACNA1HHPGDKDM4EALDH1A1RAB9A
SCHEMBL19756497 0.71 — —
SCHEMBL25680855 0.71 CHRNB2 (0.38) ACHERAB9ANPC1
SCHEMBL18505713 0.68 HDAC4 (0.42) FAAHHDAC4HDAC6PRMT3RAB9A
SCHEMBL14527437 0.68 HPGD (0.43) BCHEACHEHPGDKDM4EALDH1A1
SCHEMBL19756407 0.67 IDO1 (0.32) HPGDSMN1; SMN2LMNA

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-20170369498-A1 TRICYCLIC GYRASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-12-28 — — US disclosed
US-9732083-B2 Tricyclic gyrase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-08-15 — — 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-20170369498-A1 TRICYCLIC GYRASE INHIBITORS TOP1, TOP2A, TOP2B FAAH 2307/4885BCHE 947/4885ACHE 1285/4885

“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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