SCHEMBL20068993

SCHEMBL20068993

Cc1cc(NC(=O)c2cccnc2)ccn1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.68
▸ TDP1 Q9NUW8 1/20 0.68
▸ ROCK2 O75116 1/20 0.66
▸ ROCK1 Q13464 1/20 0.66
▸ NPC1 O15118 5/20 0.64
▸ KCNK3 O14649 1/20 0.63
▸ LMNA P02545 1/20 0.63
▸ HIF1A Q16665 1/20 0.63
▸ SMN1; SMN2 Q16637 4/20 0.60
▸ MEN1 O00255 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ TSHR P16473 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ GRM5 P41594 1/20 0.58
▸ MAPT P10636 1/20 0.57
▸ TP53 P04637 1/20 0.57

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
SCHEMBL3989785 0.85 JAK2 (0.60) RAB9ANPC1KCNK3SMN1; SMN2MEN1
SCHEMBL6918701 0.84 GRM5 (0.67) ALDH1A1GRM5
SCHEMBL23015754 0.82 RAB9A (0.64) RAB9ATDP1ROCK2ROCK1NPC1
SCHEMBL23015729 0.82 TDP1 (0.66) RAB9ATDP1ROCK2ROCK1NPC1
SCHEMBL259177 0.81 TDP1 (0.78) RAB9ATDP1ROCK2ROCK1NPC1
SCHEMBL19662756 0.81 NT5E (0.71) RAB9ANPC1KCNK3MEN1KMT2A
SCHEMBL28777431 0.81 TDP1 (1.00) RAB9ATDP1ROCK2ROCK1NPC1
SCHEMBL14880208 0.80 ROCK2 (1.00) RAB9ATDP1ROCK2ROCK1NPC1
SCHEMBL1971026 0.79 NAMPT (0.78) RAB9ATDP1ROCK2ROCK1NPC1
SCHEMBL30828594 0.79 HDAC4 (0.64) RAB9ANPC1SMN1; SMN2MEN1KMT2A

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-10927106-B2 Benzothiazole derivatives as DYRK1 inhibitors PHARMASUM THERAPEUTICS AS (NO) 2021-02-23 — — US disclosed
WO-2018069468-A1 BENZOTHIAZOLE DERIVATIVES AS DYRK1 INHIBITORS PHARMASUM THERAPEUTICS AS (NO) 2018-04-19 — — WO 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-10927106-B2 Benzothiazole derivatives as DYRK1 inhibitors DYRK1A, DYRK1B, PDK2 RAB9A 1200/4885TDP1 780/4885ROCK2 902/4885

“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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