SCHEMBL6771385

SCHEMBL6771385

NC(=O)c1ccc(-c2ccc(-c3nnn[nH]3)c(N)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 8/20 0.44
MKNK2 Q9HBH9 7/20 0.44
CHEK2 O96017 2/20 0.39
FYN P06241 1/20 0.39
MAP4K4 O95819 3/20 0.39
MYC P01106 1/20 0.38
ERN1 O75460 1/20 0.38
IKBKB O14920 2/20 0.37
PDK2 Q15119 1/20 0.37
MAPK12 P53778 1/20 0.37
PTK2 Q05397 1/20 0.37
RIPK1 Q13546 1/20 0.36
CHUK O15111 1/20 0.36

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
SCHEMBL4025859 0.89 MKNK1 (0.44) MKNK1MKNK2CHEK2FYNMAP4K4
SCHEMBL6777016 0.82 LMNA (0.45) PDK2
SCHEMBL6781647 0.82 HPGD (0.46)
SCHEMBL21856971 0.81 KDM4E (0.42) IKBKB
SCHEMBL751010 0.81 MKNK1 (0.42) MKNK1MKNK2CHEK2MAP4K4
SCHEMBL4436864 0.79 MKNK1 (0.47) MKNK1MKNK2CHEK2FYNIKBKB
SCHEMBL6777326 0.77 KIF11 (0.44) MKNK1MKNK2MAP4K4
SCHEMBL3595152 0.76 PRF1 (0.42) MKNK1MKNK2CHEK2
SCHEMBL1577476 0.76 PARP1 (0.40) CHEK2PDK2
SCHEMBL3376022 0.76 CHEK2 (0.43) MKNK1MKNK2CHEK2MAP4K4MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6696475-B2 N-PHENYL-N'-(2-CARBOXYPHENYL) UREA, FOR EXAMPLE; CHLORIDE CHANNEL BLOCKERS; SUCH AS FOR TREATING BONE METABOLIC DISORDERS NEUROSEARCH A/S (DK) 2004-02-24 US disclosed
EP-0977741-B1 SUBSTITUTED PHENYL DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH AS (DK) 2003-09-03 EP disclosed
US-20020037905-A1 Substituted phenyl derivatives, their preparation and use ANIONA APS (DK) 2002-03-28 US disclosed
US-6297261-B1 POTENT CHLORIDE CHANNEL BLOCKERS; TREATMENT OF SICKLE CELL ANEMIA, BRAIN EDEMA FOLLOWING ISCHAEMIA OR TUMORS, DIARRHEA, HYPERTENSION (DIURETIC), OSTEOPOROSIS, AND FOR THE REDUCTION OF THE INTRAOCULAR PRESSURE NEUROSEARCH A/S (DK) 2001-10-02 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-20020037905-A1 Substituted phenyl derivatives, their preparation and use KCNB1, KCNH2, KCNJ2 MKNK1 4122/4885MKNK2 4146/4885CHEK2 4757/4885

“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.