SCHEMBL2646534

SCHEMBL2646534

CNC(=O)c1ccccc1O[O]

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 1/20 0.55
BAZ2B Q9UIF8 1/20 0.55
GAA P10253 2/20 0.55
PLK1 P53350 2/20 0.52
CTSD P07339 1/20 0.50
HPGD P15428 2/20 0.47
TP53 P04637 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
GLA P06280 1/20 0.47
STAT3 P40763 1/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
HCRTR1 O43613 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
KCNK3 O14649 1/20 0.45
KCNK9 Q9NPC2 1/20 0.45

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
SCHEMBL2646539 0.86 KAT2B (0.57) KAT2BBAZ2BGAAPLK1CTSD
SCHEMBL353828 0.84 CTSD (0.70) GAAPLK1CTSDHPGDTP53
Hydrochloric Acid SCHEMBL7476155 0.82 CTSD (0.68) GAAPLK1CTSDHPGDTP53
SCHEMBL2537963 0.82 KAT2B (0.54) KAT2BBAZ2BGAAPLK1CTSD
SCHEMBL19501704 0.82 KAT2B (0.54) KAT2BBAZ2BGAAPLK1CTSD
SCHEMBL1800799 0.81 HSD17B10 (0.65) KAT2BBAZ2BGAAPLK1CTSD
SCHEMBL2344909 0.80 GAA (0.71) KAT2BBAZ2BGAAPLK1SMN1; SMN2
SCHEMBL6846935 0.79 RAB9A (0.63) KAT2BBAZ2BGAAHPGDRAB9A
Alcohol SCHEMBL6834845 0.79 CTSD (0.69) GAAPLK1CTSDHPGDTP53
SCHEMBL6400854 0.79 HCRTR1 (0.73) GAAHPGDRXFP1RAB9AHCRTR1

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
EP-1702919-B1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE MSD KK (JP) 2012-05-30 EP disclosed
US-7728025-B2 2-heteroaryl-substituted benzimidazole derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-01 US disclosed
US-20080070928-A1 Novel 2-Heteroaryl-Substituted Benzimidazole Derivative MSD K.K. (JP) 2008-03-20 US disclosed
EP-1702919-A1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-09-20 EP 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-20080070928-A1 Novel 2-Heteroaryl-Substituted Benzimidazole Derivative GCK, GCKR, HK1 KAT2B 1405/4885BAZ2B 1129/4885GAA 86/4885

“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.