SCHEMBL16468910

SCHEMBL16468910

CC(c1ccccc1)N(CC(=O)Nc1ccc(-c2csc(N)n2)cc1)C(=O)c1ccncc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ROCK1 Q13464 10/20 0.49
▸ ROCK2 O75116 9/20 0.49
▸ MEN1 O00255 5/20 0.48
▸ KMT2A Q03164 5/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ MAPT P10636 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ GRM1 Q13255 1/20 0.45
▸ SLC6A9 P48067 2/20 0.45
▸ NPC1 O15118 3/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ GFER P55789 1/20 0.42
▸ PARP1 P09874 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
SCHEMBL16468911 1.00 ROCK1 (0.49) ROCK1ROCK2MEN1KMT2ARAB9A
SCHEMBL7463048 0.81 CYP3A4 (0.57) ROCK1ROCK2MEN1KMT2ARAB9A
SCHEMBL7473115 0.73 LTA4H (0.46) ROCK1ROCK2MEN1KMT2ARAB9A
SCHEMBL7473110 0.73 LTA4H (0.46) ROCK1ROCK2MEN1KMT2ARAB9A
SCHEMBL27601320 0.72 MEN1 (0.48) MEN1KMT2ARAB9AALDH1A1MAPT
Hydrochloric Acid SCHEMBL6174792 0.72 MEN1 (0.48) MEN1KMT2ARAB9AALDH1A1MAPT
SCHEMBL14825155 0.70 RAB9A (0.75) MEN1KMT2ARAB9AALDH1A1MAPT
SCHEMBL7478638 0.70 MEN1 (0.50) ROCK1ROCK2MEN1KMT2ARAB9A
SCHEMBL18114095 0.69 MEN1 (0.74) MEN1KMT2ARAB9AALDH1A1MAPT
Hydrochloric Acid SCHEMBL6173338 0.68 RAB9A (0.50) ROCK1MEN1KMT2ARAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160346287-A1 METHOD OF TREATING VIRAL INFECTIONS EPIPHANY BIOSCIENCES, INC. 2016-12-01 — — US claimed
US-20150050241-A1 METHOD OF TREATING VIRAL INFECTIONS EPIPHANY BIOSCIENCES, INC. 2015-02-19 — — US claimed
WO-2021188974-A1 RIBONUCLEASES FOR TREATING VIRAL INFECTIONS ORGENESIS INC. (US) 2021-09-23 — — WO disclosed
WO-2021188866-A1 RIBONUCLEASES FOR TREATING VIRAL INFECTIONS ORGENESIS INC. (US) 2021-09-23 — — WO disclosed
US-20160346287-A1 METHOD OF TREATING VIRAL INFECTIONS EPIPHANY BIOSCIENCES, INC. 2016-12-01 — — US disclosed
US-20150050241-A1 METHOD OF TREATING VIRAL INFECTIONS EPIPHANY BIOSCIENCES, INC. 2015-02-19 — — 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-20160346287-A1 METHOD OF TREATING VIRAL INFECTIONS IFNG, BCL9, GDA ROCK1 4385/4885ROCK2 3988/4885MEN1 74/4885
US-20150050241-A1 METHOD OF TREATING VIRAL INFECTIONS IFNG, BCL9, GDA ROCK1 4385/4885ROCK2 3988/4885MEN1 74/4885

“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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